SCHEMBL518966

SCHEMBL518966

CN1CCN(c2ccc([C]=O)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
ALDH1A1 P00352 2/20 0.57
KDM4E B2RXH2 2/20 0.57
GAA P10253 2/20 0.57
PTK2B Q14289 2/20 0.57
ADRA2C P18825 1/20 0.57
GFER P55789 1/20 0.57
KMT2A Q03164 1/20 0.57
ESR2 Q92731 1/20 0.57
SIRT6 Q8N6T7 1/20 0.53
LMNA P02545 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
TP53 P04637 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CHEK1 O14757 1/20 0.48
CHKA P35790 1/20 0.46
HTR3A P46098 1/20 0.46
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL27896885 0.94 MAPT (0.52) MAPTALDH1A1KDM4EGAAPTK2B
SCHEMBL16583186 0.81 TRIM24 (0.52) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL151261 0.80 CHEK1 (0.68) MAPTALDH1A1KDM4EGAAPTK2B
SCHEMBL7496780 0.80 KDM4E (0.57) MAPTALDH1A1KDM4EGAAPTK2B
SCHEMBL13353048 0.80 MAPT (0.57) MAPTALDH1A1KDM4EGAAPTK2B
SCHEMBL6405205 0.79 GAA (0.61) MAPTKDM4EGAAADRA2CGFER
SCHEMBL4871815 0.79 ALDH1A1 (0.53) MAPTALDH1A1KDM4EGAAGFER
SCHEMBL517732 0.78 LMNA (0.52) MAPTALDH1A1KDM4EKMT2ALMNA
SCHEMBL11025720 0.77 GAA (0.63) MAPTALDH1A1KDM4EGAAPTK2B
SCHEMBL6223030 0.77 CHKA (0.51) MAPTALDH1A1KDM4EGAAPTK2B

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102174035-B Aromatic dihydrazide type PLK1 (Polo-like Kinase 1) inhibitor and applications thereof UNIV CHINA PHARMA 2015-01-07 CN claimed
CN-103102314-A Benzothiazole, benzimidazole, benzoxazole derivatives and preparation method and application thereof UNIV SICHUAN 2013-05-15 CN claimed
CN-102174035-A Aromatic dihydrazide type PLK1 (Polo-like Kinase 1) inhibitor and applications thereof UNIV CHINA PHARMA 2011-09-07 CN claimed
US-6900237-B2 Sulfonamide compounds as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-05-31 US claimed
US-20030158231-A1 Sulfonamide compounds as protease inhibitors Celera Corporation 2003-08-21 US claimed
US-10941134-B2 AMPK-activating heterocyclic compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2021-03-09 US disclosed
US-10377742-B2 AMPK-activating heterocyclic compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2019-08-13 US disclosed
US-20180057478-A1 AMPK-ACTIVATING HETEROCYCLIC COMPOUNDS AND METHODS FOR USING THE SAME RIGEL PHARMACEUTICALS, INC. (US) 2018-03-01 US disclosed
US-9663496-B2 AMPK-activating heterocyclic compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
CN-103201267-B AMPK-activating heterocyclic compounds and methods of use thereof 里格尔药品股份有限公司 2016-08-17 CN disclosed
US-20160229838-A1 AMPK-ACTIVATING HETEROCYCLIC COMPOUNDS AND METHODS FOR USING THE SAME MIDCAP FINANCIAL TRUST 2016-08-11 US disclosed
US-9266856-B2 AMPK—activating heterocyclic compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2016-02-23 US disclosed
US-20120028954-A1 Substituted Pyridine, Pyridazine, Pyrazine And Pyrimidine Compounds And Methods For Using The Same RIGEL PHARMACEUTICALS, INC. (US) 2012-02-02 US disclosed
CN-102174035-A Aromatic dihydrazide type PLK1 (Polo-like Kinase 1) inhibitor and applications thereof UNIV CHINA PHARMA 2011-09-07 CN disclosed
CN-101611014-A Amidopyrazoles as FGFR inhibitors ASTRAZENECA AB (SE) 2009-12-23 CN disclosed
EP-2051985-A2 PYRAZOLO[4,3-D]THIAZOLE DERIVATIVES, AND PREPARATION AND THERAPUETIC APPLICATION THEREOF Sanofi-Aventis (FR) 2009-04-29 EP disclosed
WO-2008015340-A2 PYRAZOLO[4,3-D]THIAZOLE DERIVATIVES, AND PREPARATION AND THERAPUETIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2008-02-07 WO disclosed
US-6900237-B2 Sulfonamide compounds as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-05-31 US disclosed
US-20030158231-A1 Sulfonamide compounds as protease inhibitors Celera Corporation 2003-08-21 US disclosed
WO-2003024923-A1 SULFONAMIDE COMPOUNDS AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2003-03-27 WO 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 (6 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-20160229838-A1 AMPK-ACTIVATING HETEROCYCLIC COMPOUNDS AND METHODS FOR USING THE SAME PRKAG1, PRKAG2, PRKAB1 MAPT 2435/4885ALDH1A1 807/4885KDM4E 926/4885
US-20120028954-A1 Substituted Pyridine, Pyridazine, Pyrazine And Pyrimidine Compounds And Methods For Using The Same AK2, PC, PRKAG2 MAPT 2071/4885ALDH1A1 1146/4885KDM4E 752/4885
US-20180057478-A1 AMPK-ACTIVATING HETEROCYCLIC COMPOUNDS AND METHODS FOR USING THE SAME PRKAG1, PRKAG2, PRKAB1 MAPT 2435/4885ALDH1A1 807/4885KDM4E 926/4885
US-10941134-B2 AMPK-activating heterocyclic compounds and methods for using the same PRKAG1, PRKAG2, PRKAB1 MAPT 2435/4885ALDH1A1 807/4885KDM4E 926/4885
US-20030158231-A1 Sulfonamide compounds as protease inhibitors PRSS1, PRSS3, SPINT2 MAPT 2884/4885ALDH1A1 2068/4885KDM4E 3579/4885
US-10377742-B2 AMPK-activating heterocyclic compounds and methods for using the same PRKAG1, PRKAG2, PRKAB1 MAPT 2435/4885ALDH1A1 807/4885KDM4E 926/4885

“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.