SCHEMBL7859091

SCHEMBL7859091

Fc1ccc(-n2cc(-c3ccnc4ccccc34)cn2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 19/20 1.00
▸ KCNH2 Q12809 2/20 0.80
▸ HTR2B P41595 1/20 0.80
▸ MTNR1A P48039 1/20 0.80
▸ MAPT P10636 1/20 0.52
▸ RECQL P46063 1/20 0.52
▸ RAB9A P51151 1/20 0.52

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
SCHEMBL15942032 0.89 GRM4 (1.00) GRM4KCNH2HTR2BMTNR1A
SCHEMBL18292374 0.84 GRM4 (0.74) GRM4KCNH2HTR2BMTNR1A
SCHEMBL2710540 0.83 GRM4 (0.77) GRM4KCNH2HTR2BMTNR1A
SCHEMBL28199101 0.82 GRM4 (0.85) GRM4KCNH2HTR2BMTNR1A
SCHEMBL17125376 0.79 GRM4 (0.67) GRM4KCNH2HTR2BMTNR1A
SCHEMBL31014179 0.78 GRM4 (0.62) GRM4KCNH2HTR2BMTNR1AMAPT
SCHEMBL18805529 0.78 GRM4 (0.62) GRM4KCNH2HTR2BMTNR1AMAPT
SCHEMBL5318173 0.78 GRM4 (0.62) GRM4KCNH2HTR2BMTNR1AMAPT
SCHEMBL355762 0.75 GRM4 (0.65) GRM4KCNH2HTR2BMTNR1A
SCHEMBL31428975 0.75 GRM4 (0.65) GRM4KCNH2HTR2BMTNR1A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1264377-A Substituted pyrazoles as P38 kinase inhabitors SEARLE & CO (US) 2000-08-23 — — CN claimed
EP-1000055-A1 SUBSTITUTED PYRAZOLES AS p38 KINASE INHIBITORS G.D. Searle & Co. (US) 2000-05-17 — — EP claimed
WO-1998052940-A1 SUBSTITUTED PYRAZOLES AS p38 KINASE INHIBITORS G.D. SEARLE AND CO. (US) 1998-11-26 — — WO claimed
CN-1342157-A Substituted pyrazoles ASP38 kinase inhibitors SEARLE & CO (US) 2002-03-27 — — CN disclosed
EP-1144403-A1 SUBSTITUED PYRAZOLES AS P38 KINASE INHIBITORS G.D. SEARLE & CO. (US) 2001-10-17 — — EP disclosed
CN-1273603-A Attenuated respiratory syncytial virus AMERICAN CYANAMID CO (US) 2000-11-15 — — CN disclosed
WO-2000031063-A1 SUBSTITUTED PYRAZOLES AS p38 KINASE INHIBITORS G.D. SEARLE & CO. (US) 2000-06-02 — — WO disclosed
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