SCHEMBL3038853

SCHEMBL3038853

CCN(CC)CCc1ccccn1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.55
KDM4E B2RXH2 3/20 0.55
TSHR P16473 2/20 0.55
POLB P06746 1/20 0.55
MAPT P10636 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
LIN28A Q9H9Z2 1/20 0.55
DRD2 P14416 1/20 0.53
HTR2A P28223 1/20 0.53
HRH1 P35367 2/20 0.52
HRH3 Q9Y5N1 1/20 0.52
CYP1A2 P05177 2/20 0.51
CYP3A4 P08684 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
LMNA P02545 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
ALDH1A1 P00352 1/20 0.50
ALOX15 P16050 1/20 0.50
CYP2D6 P10635 2/20 0.48
CYP2C9 P11712 2/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29733030 1.00 TDP1 (0.55) TDP1KDM4ETSHRPOLBMAPT
Hydrochloric Acid SCHEMBL11526658 0.98 TDP1 (0.54) TDP1KDM4ETSHRPOLBMAPT
SCHEMBL4961822 0.88 TDP1 (0.63) TDP1KDM4ETSHRPOLBMAPT
SCHEMBL20746628 0.87 TDP1 (0.54) TDP1KDM4ETSHRPOLBMAPT
SCHEMBL6033690 0.83 KDM4E (0.67) TDP1KDM4ETSHRPOLBMAPT
SCHEMBL4033092 0.82 TDP1 (0.74) TDP1KDM4ETSHRPOLBMAPT
SCHEMBL8772399 0.82 TDP1 (0.81) TDP1KDM4ETSHRPOLBMAPT
SCHEMBL7106696 0.82 SMN1; SMN2 (0.57) TDP1KDM4ETSHRPOLBMAPT
SCHEMBL7105171 0.82 SMN1; SMN2 (0.57) TDP1KDM4ETSHRPOLBMAPT
SCHEMBL30398318 0.81 TDP1 (0.49) TDP1KDM4ETSHRPOLBMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 56 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114609074-A Method for detecting content of cyclic amine compound in copper etching solution 江苏和达电子科技有限公司 2022-06-10 CN claimed
CN-109320718-A A kind of high barrier transparent flexible display material and preparation method thereof 中国科学院长春应用化学研究所 2019-02-12 CN claimed
CN-104130184-B The manufacture method of the compound that contains pyridine ring and halogenated methyl pyridine derivate and tetrazole radical 9 oxime derivate 日本曹达株式会社 2016-06-15 CN claimed
CN-102797043-B Medicinal molecular fragment library and construction process thereof Tianli (Tianjin) Technology Co., Ltd. (CN) 2015-11-25 CN claimed
CN-104130184-A Compound containing pyridine ring and method for producing halogenated picoline derivative and tetrazolyloxime derivative NIPPON SODA CO 2014-11-05 CN claimed
US-8735586-B2 Regioselective copper catalyzed synthesis of benzimidazoles and azabenzimidazoles SANOFI (FR) 2014-05-27 US claimed
CN-102797043-A Medicinal molecular fragment library and construction method thereof CBB NETWORK CO LTD 2012-11-28 CN claimed
CN-102791691-A Compound containing pyridine ring, halogenated picoline derivative, and method for producing tetrazolyloxime derivative NIPPON SODA CO 2012-11-21 CN claimed
EP-2173721-B1 A REGIOSELECTIVE COPPER CATALYZED SYNTHESIS OF BENZIMIDAZOLES AND AZABENZIMIDAZOLES SANOFI SA (FR) 2011-12-28 EP claimed
EP-2173747-B1 A REGIOSELECTIVE METAL CATALYZED SYNTHESIS OF ANNELATED BENZIMIDAZOLES AND AZABENZIMIDAZOLES SANOFI SA (FR) 2011-12-21 EP claimed
US-20100261909-A1 Regioselective copper catalyzed synthesis of benzimidazoles and azabenzimidazoles SANOFI-AVENTIS (FR) 2010-10-14 US claimed
US-20100216988-A1 Regioselective metal catalyzed synthesis of annelated benzimidazoles and azabenzimidazoles SANOFI-AVENTIS (FR) 2010-08-26 US claimed
EP-2173747-A1 A REGIOSELECTIVE METAL CATALYZED SYNTHESIS OF ANNELATED BENZIMIDAZOLES AND AZABENZIMIDAZOLES Sanofi-Aventis (FR) 2010-04-14 EP claimed
EP-2173721-A1 A REGIOSELECTIVE COPPER CATALYZED SYNTHESIS OF BENZIMIDAZOLES AND AZABENZIMIDAZOLES Sanofi-Aventis (FR) 2010-04-14 EP claimed
CN-101687865-A A regioselective metal catalyzed synthesis of annelated benzimidazoles and azabenzimidazoles SANOFI AVENTIS 2010-03-31 CN claimed
CN-101687815-A Regioselective copper catalyzed synthesis of benzimidazoles and azabenzimidazoles SANOFI AVENTIS 2010-03-31 CN claimed
WO-2009000413-A1 A REGIOSELECTIVE COPPER CATALYZED SYNTHESIS OF BENZIMIDAZOLES AND AZABENZIMIDAZOLES SANOFI-AVENTIS (FR) 2008-12-31 WO claimed
WO-2009000412-A1 A REGIOSELECTIVE METAL CATALYZED SYNTHESIS OF ANNELATED BENZIMIDAZOLES AND AZABENZIMIDAZOLES SANOFI AVENTIS (FR) 2008-12-31 WO claimed
US-4116968-A PROCESS FOR THE PRODUCTION OF 2-VINYL PYRIDINE LONZA, LTD. (CH) 1978-09-26 US claimed
CN-114609074-A Method for detecting content of cyclic amine compound in copper etching solution 江苏和达电子科技有限公司 2022-06-10 CN disclosed
CN-109320718-A A kind of high barrier transparent flexible display material and preparation method thereof 中国科学院长春应用化学研究所 2019-02-12 CN disclosed
CN-104220417-B Use the method for aryl hydrazines synthesizing amino biphenyl class 巴斯夫欧洲公司 2017-10-13 CN disclosed
CN-104109150-B COMPOUND CONTAINING PYRIDINE RING AND METHOD FOR PRODUCING HALOGENATED PICOLINE DERIVATIVE AND TETRAZOLYLOXIME DERIVATIVE 日本曹达株式会社 2017-04-12 CN disclosed
CN-104072408-B Compound containing pyridine ring and halogenated methyl pyridine derivate and the manufacture method of tetrazole radical 9 oxime derivate 日本曹达株式会社 2016-09-14 CN disclosed
CN-104130184-B The manufacture method of the compound that contains pyridine ring and halogenated methyl pyridine derivate and tetrazole radical 9 oxime derivate 日本曹达株式会社 2016-06-15 CN disclosed
CN-104072483-B The manufacture method of the compound containing pyridine ring and halogenated methyl pyridine derivate and tetrazyl 9 oxime derivate NIPPON SODA CO., LTD. (JP) 2016-04-13 CN disclosed
CN-102797043-B Medicinal molecular fragment library and construction process thereof Tianli (Tianjin) Technology Co., Ltd. (CN) 2015-11-25 CN disclosed
CN-102791691-B Compound containing pyridine ring, halogenated picoline derivative, and method for producing tetrazolyloxime derivative NIPPON SODA CO 2015-06-03 CN disclosed
CN-104220417-A Method for synthesising aminobiphenyls using aryl hydrazines BASF SE 2014-12-17 CN disclosed
CN-104130184-A Compound containing pyridine ring and method for producing halogenated picoline derivative and tetrazolyloxime derivative NIPPON SODA CO 2014-11-05 CN disclosed
CN-104109150-A Compound Containing Pyridine Ring And Method For Producing Halogenated Picoline Derivative And Tetrazolyloxime Derivative NIPPON SODA CO 2014-10-22 CN disclosed
CN-102143935-B Process for producing aminobiphenyls BASF SE (DE) 2014-10-22 CN disclosed
CN-104072408-A Compound containing pyridine ring and method for producing halogenated picoline derivative and tetrazolyloxime derivative NIPPON SODA CO 2014-10-01 CN disclosed
CN-104072483-A Compound containing pyridine ring and method for producing halogenated picoline derivative and tetrazolyloxime derivative NIPPON SODA CO 2014-10-01 CN disclosed
US-8735586-B2 Regioselective copper catalyzed synthesis of benzimidazoles and azabenzimidazoles SANOFI (FR) 2014-05-27 US disclosed
CN-102797043-A Medicinal molecular fragment library and construction method thereof CBB NETWORK CO LTD 2012-11-28 CN disclosed
CN-102791691-A Compound containing pyridine ring, halogenated picoline derivative, and method for producing tetrazolyloxime derivative NIPPON SODA CO 2012-11-21 CN disclosed
EP-2173721-B1 A REGIOSELECTIVE COPPER CATALYZED SYNTHESIS OF BENZIMIDAZOLES AND AZABENZIMIDAZOLES SANOFI SA (FR) 2011-12-28 EP disclosed
EP-2173747-B1 A REGIOSELECTIVE METAL CATALYZED SYNTHESIS OF ANNELATED BENZIMIDAZOLES AND AZABENZIMIDAZOLES SANOFI SA (FR) 2011-12-21 EP disclosed
CN-102143935-A Process for producing aminobiphenyls UNIV MUENCHEN TECH 2011-08-03 CN disclosed
US-20100261909-A1 Regioselective copper catalyzed synthesis of benzimidazoles and azabenzimidazoles SANOFI-AVENTIS (FR) 2010-10-14 US disclosed
US-20100216988-A1 Regioselective metal catalyzed synthesis of annelated benzimidazoles and azabenzimidazoles SANOFI-AVENTIS (FR) 2010-08-26 US disclosed
EP-2173721-A1 A REGIOSELECTIVE COPPER CATALYZED SYNTHESIS OF BENZIMIDAZOLES AND AZABENZIMIDAZOLES Sanofi-Aventis (FR) 2010-04-14 EP disclosed
EP-2173747-A1 A REGIOSELECTIVE METAL CATALYZED SYNTHESIS OF ANNELATED BENZIMIDAZOLES AND AZABENZIMIDAZOLES Sanofi-Aventis (FR) 2010-04-14 EP disclosed
CN-101687865-A A regioselective metal catalyzed synthesis of annelated benzimidazoles and azabenzimidazoles SANOFI AVENTIS 2010-03-31 CN disclosed
CN-101687815-A Regioselective copper catalyzed synthesis of benzimidazoles and azabenzimidazoles SANOFI AVENTIS 2010-03-31 CN disclosed
WO-2009000413-A1 A REGIOSELECTIVE COPPER CATALYZED SYNTHESIS OF BENZIMIDAZOLES AND AZABENZIMIDAZOLES SANOFI-AVENTIS (FR) 2008-12-31 WO disclosed
WO-2009000412-A1 A REGIOSELECTIVE METAL CATALYZED SYNTHESIS OF ANNELATED BENZIMIDAZOLES AND AZABENZIMIDAZOLES SANOFI AVENTIS (FR) 2008-12-31 WO disclosed
EP-0220963-B1 ADSORPTION OF GASES BY AMINE AND PHOSPHINE COMPLEXED MN(II) COMPOUNDS UNIVERSITY OF CINCINNATI (US) 1992-04-01 EP disclosed
US-4713091-A Adsorption of gases by amine and phosphine complexed Mn(II) and compounds UNIVERSITY OF CINCINNATI (US) 1987-12-15 US disclosed
US-4668255-A Adsorption of gases by amine complexed Mn (II) UNIVERSITY OF CINCINNATI (US) 1987-05-26 US disclosed
EP-0220963-A2 Adsorption of gases by amine and phosphine complexed Mn(II) compounds UNIVERSITY OF CINCINNATI (US) 1987-05-06 EP disclosed
US-4515708-A BETA-PYRIDYLETHYLAMINE EXXON RESEARCH & ENGINEERING CO. (US) 1985-05-07 US disclosed
US-4196287-A Process for the catalytic production of 2-substituted pyridines LONZA LTD. (CH) 1980-04-01 US disclosed
US-4159332-A Prevention of or reduction in severity of myocardial infarction UNIMED, INC. (US) 1979-06-26 US disclosed
US-4116968-A PROCESS FOR THE PRODUCTION OF 2-VINYL PYRIDINE LONZA, LTD. (CH) 1978-09-26 US disclosed
US-4116968-A PROCESS FOR THE PRODUCTION OF 2-VINYL PYRIDINE LONZA, LTD. (CH) 1978-09-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100261909-A1 Regioselective copper catalyzed synthesis of benzimidazoles and azabenzimidazoles AZI2, NISCH, UQCRB TDP1 3404/4885KDM4E 1197/4885TSHR 1319/4885
US-20100216988-A1 Regioselective metal catalyzed synthesis of annelated benzimidazoles and azabenzimidazoles AZI2, NIT2, NISCH TDP1 2817/4885KDM4E 478/4885TSHR 1835/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.