SCHEMBL3084897

SCHEMBL3084897

Clc1cc2c(s1)CCNC2

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PNMT P11086 11/20 0.61
PARP1 P09874 1/20 0.40
KCNH2 Q12809 1/20 0.40
PARP2 Q9UGN5 1/20 0.40
ASIC3 Q9UHC3 1/20 0.39
CD44 P16070 1/20 0.38
MAOB P27338 1/20 0.38
TPSAB1 Q15661 1/20 0.36
TPSD1 Q9BZJ3 1/20 0.36
TPSG1 Q9NRR2 1/20 0.36
F10 P00742 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36

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
SCHEMBL3586535 0.89 PNMT (0.49) PNMTPARP1KCNH2PARP2ASIC3
SCHEMBL3004190 0.86 PNMT (0.44) PNMT
SCHEMBL29356870 0.84 PNMT (0.47) PNMTPARP1KCNH2PARP2ASIC3
SCHEMBL5557141 0.82 PNMT (0.42) PNMT
SCHEMBL21236155 0.78 PNMT (0.63) PNMTPARP1PARP2ASIC3CD44
SCHEMBL23142158 0.77 PNMT (0.42) PNMTPARP1KCNH2PARP2ASIC3
SCHEMBL17613134 0.76 PNMT (0.61) PNMTPARP1PARP2ASIC3CD44
SCHEMBL6424327 0.76 PNMT (1.00) PNMTASIC3CD44MAOBTPSAB1
SCHEMBL12126395 0.76 PNMT (0.61) PNMTPARP1KCNH2PARP2CD44
SCHEMBL1427612 0.76 PNMT (0.61) PNMTPARP1PARP2ASIC3CD44

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109311853-B Triazole derivatives and their use in agriculture 东莞市东阳光农药研发有限公司 2020-02-11 CN disclosed
CN-1993324-B 3-(((4-phenyl)-piperazin-1-yl)-alkyl)-3-alkyl-1,3-dihydro-2h-indol-2-one derivatives and related compounds for the treatment of central nervous system disorders EGYT GYOGYSZERVEGYESZETI GYAR 2010-12-15 CN disclosed
US-7786129-B2 Piperazine derivatives of dialkyl oxindoles EGIS GYOGYSZERGYAR NYRT (HU) 2010-08-31 US disclosed
CN-100572377-C The indol-2-one derivates of treatment nervus centralis obstacle, gastrointestinal disorders and cardiovascular disorder EGIS PHARMACEUTICAL WORKS (HU) 2009-12-23 CN disclosed
US-20090306144-A1 PYRIDINE DERIVATIVES OF ALKYL OXINDOLES AS 5-HT7 RECEPTOR ACTIVE AGENTS VOLK BALAZS 2009-12-10 US disclosed
US-20090281137-A1 INDOL-2-ONE DERIVATIVES FOR THE TREATMENT OF CENTRAL NERVOUS DISORDERS, GASTROINTESTINAL DISORDERS AND CARDIOVASCULAR DISORDERS VOLK BALAZS 2009-11-12 US disclosed
EP-1751138-B9 INDOL-2-ONE DERIVATIVES FOR THE TREATMENT OF CENTRAL NERVOUS DISORDERS, GASTROINTESTINAL DISORDERS AND CARDIOVASCULAR DISORDERS EGIS GYOGYSZERGYAR NYRT (HU) 2008-11-12 EP disclosed
EP-1751138-B1 INDOL-2-ONE DERIVATIVES FOR THE TREATMENT OF CENTRAL NERVOUS DISORDERS, GASTROINTESTINAL DISORDERS AND CARDIOVASCULAR DISORDERS EGIS GYOGYSZERGYAR NYRT (HU) 2007-12-26 EP disclosed
US-20070265300-A1 Pyridine Derivatives of Alkyl Oxindoles as 5-Ht7 Receptor Active Agents EGIS GYOGYSZERGYAR RT. (HU) 2007-11-15 US disclosed
US-20070232619-A1 Piperazine Derivatives of Dialkyl Oxindoles EGIS GYOGYSZERGYAR RT. (HU) 2007-10-04 US disclosed
CN-101010313-A Indol-2-one derivatives for the treatment of central nervous disorders, gastrointestinal disorders and cardiovascular disorders EGIS PHARMACEUTICAL WORKS (HU) 2007-08-01 CN disclosed
CN-1993324-A 3-(((4-phenyl)-piperazin-1-yl)-alkyl)-3-alkyl-1,3-dihydro-2h-indol-2-one derivatives and related compounds for the treatment of central nervous system disorders EGIS GYOGYSZERGYAR NYRT (HU) 2007-07-04 CN disclosed
CN-1976917-A Pyridine derivatives of alkyl oxindoles as 5-HT 7 receptor active agents EGIS GYOGYSZERGYAR NYRT (HU) 2007-06-06 CN disclosed
EP-1776339-A2 3-(((4-PHENYL)-PIPERAZIN-1-YL)-ALKYL)-3-ALKYL-1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS EGIS Gyógyszergyár Nyrt (HU) 2007-04-25 EP disclosed
WO-2005109987-A9 3-(((4-PHENYL)-PIPERAZINE-1-YL)-ALKYL)-3-ALKYL-1, 3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS EGIS GYOGYSZERGYAR NYRT (HU) 2007-03-29 WO disclosed
EP-1751138-A1 INDOL-2-ONE DERIVATIVES FOR THE TREATMENT OF CENTRAL NERVOUS DISORDERS, GASTROINTESTINAL DISORDERS AND CARDIOVASCULAR DISORDERS EGIS Gyógyszergyár Nyrt (HU) 2007-02-14 EP disclosed
EP-1751134-A1 PYRIDINE DERIVATIVES OF ALKYL OXINDOLES AS 5-HT7 RECEPTOR ACTIVE AGENTS EGIS Gyógyszergyár Nyrt (HU) 2007-02-14 EP disclosed
WO-2005109987-A2 3-(((4-PHENYL)-PIPERAZINE-1-YL)-ALKYL)-3-ALKYL-1, 3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS EGIS GYÓGYSZERGYÁR NYRT. (HU) 2005-11-24 WO disclosed
WO-2005108388-A1 PYRIDINE DERIVATIVES OF ALKYL OXINDOLES AS 5-HT7 RECEPTOR ACTIVE AGENTS EGIS GYÓGYSZERGYÁR NYRT. (HU) 2005-11-17 WO disclosed
WO-2005108390-A1 INDOL-2-ONE DERIVATIVES FOR THE TREATMENT OF CENTRAL NERVOUS DISORDERS, GASTROINTESTINAL DISORDERS AND CARDIOVASCULAR DISORDERS EGIS GYÓGYSZERGYÁR NYRT. (HU) 2005-11-17 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 (4 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-20070232619-A1 Piperazine Derivatives of Dialkyl Oxindoles TPH2, DRD3, CNR2 PNMT 755/4885PARP1 3285/4885KCNH2 288/4885
US-20090306144-A1 PYRIDINE DERIVATIVES OF ALKYL OXINDOLES AS 5-HT7 RECEPTOR ACTIVE AGENTS HTR7, HTR2C, HTR1A PNMT 66/4885PARP1 2782/4885KCNH2 1575/4885
US-20070265300-A1 Pyridine Derivatives of Alkyl Oxindoles as 5-Ht7 Receptor Active Agents HTR7, HTR2C, HTR1A PNMT 64/4885PARP1 2814/4885KCNH2 1219/4885
US-20090281137-A1 INDOL-2-ONE DERIVATIVES FOR THE TREATMENT OF CENTRAL NERVOUS DISORDERS, GASTROINTESTINAL DISORDERS AND CARDIOVASCULAR DISORDERS TPH2, TPH1, IDO1 PNMT 44/4885PARP1 3595/4885KCNH2 710/4885

“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.