SCHEMBL1289780

SCHEMBL1289780

CN1C2C[CH]CC1CCC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.46
LMNA P02545 1/20 0.35
CYP2C9 P11712 1/20 0.35
CHRNB4 P30926 2/20 0.34
CHRNA3 P32297 2/20 0.34
CHRM4 P08173 2/20 0.34
HTR3E A5X5Y0 1/20 0.34
HTR3B O95264 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRNB2 P17787 1/20 0.34
HRH1 P35367 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
HTR3A P46098 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34
HTR3D Q70Z44 1/20 0.34
HTR3C Q8WXA8 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31

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
SCHEMBL16338628 1.00 MAPK1 (0.46) MAPK1LMNACYP2C9CHRNB4CHRNA3
SCHEMBL157432 0.88
SCHEMBL3242641 0.88
SCHEMBL2386084 0.88
SCHEMBL410993 0.78 MAPK1 (0.57) MAPK1LMNACYP2C9CHRNB4CHRNA3
SCHEMBL14320158 0.78 MAPK1 (0.57) MAPK1LMNACYP2C9CHRNB4CHRNA3
SCHEMBL4108623 0.77 MAPK1 (0.32) MAPK1CCNT1CDK9
SCHEMBL44881 0.76
SCHEMBL22311884 0.76
SCHEMBL278483 0.76 MAPK1 (0.55) MAPK1LMNACYP2C9CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2897939-B1 BENZOIMIDAZOLE-CARBOXYLIC ACID AMIDE DERIVATIVES FOR TREATING METABOLIC OR CARDIOVASCULAR DISEASES SANOFI SA (FR) 2017-02-01 EP claimed
US-9156796-B2 Benzoimidazole-carboxylic acid amide derivatives as APJ receptor modulators SANOFI (FR) 2015-10-13 US claimed
EP-2897939-A1 BENZOIMIDAZOLE-CARBOXYLIC ACID AMIDE DERIVATIVES AS APJ RECEPTOR MODULATORS SANOFI (FR) 2015-07-29 EP claimed
WO-2014044738-A1 BENZOIMIDAZOLE-CARBOXYLIC ACID AMIDE DERIVATIVES AS APJ RECEPTOR MODULATORS SANOFI (FR) 2014-03-27 WO claimed
US-7501438-B2 Pyridoimidazole derivatives FOREST LABORATORIES HOLDINGS LIMITED (BM) 2009-03-10 US claimed
US-5563148-A BICYCLIC ESTERS OR AMIDES; USED IN TREATING MIGRAINE, EMESIS, GASTROINTESTINAL DISORDERS, SCHIZOPHRENIA OR ANXIETY IN MAMMALS ELI LILLY AND COMPANY (US) 1996-10-08 US claimed
US-5491148-A TREATING GASTROINTESTINAL, CARDIOVASCULAR, CENTRAL NERVOUS SYSTEM DISORDERS, EMESIS, PAIN SYNTEX (U.S.A.) INC. (US) 1996-02-13 US claimed
EP-0307172-B1 Improvements in or relating to specific 5-HT3 antagonists LILLY CO ELI (US) 1995-10-11 EP claimed
EP-0430190-B1 New tricyclic compounds SYNTEX INC (US) 1995-07-05 EP claimed
US-5364863-A Treatment of migraine, emesis, schizophrenia, anxiety, gastrointestinal disorders ELI LILLY AND COMPANY (US) 1994-11-15 US claimed
US-5202333-A Tricyclic 5-HT3 receptor antagonists SYNTEX (U.S.A.) INC. (US) 1993-04-13 US claimed
US-5189041-A Gastrointestinal and nervous system disorders, cardiovascular disorders, analgesics SYNTEX (U.S.A.) INC. (US) 1993-02-23 US claimed
EP-0490263-A1 Alpha-oxoacetamide derivatives SYNTEX (U.S.A.) INC. (US) 1992-06-17 EP claimed
EP-0485962-A2 New tricyclic compounds SYNTEX (U.S.A.) INC. (US) 1992-05-20 EP claimed
EP-0457243-A1 Novel tricyclic compounds SYNTEX (U.S.A.) INC. (US) 1991-11-21 EP claimed
WO-1991016888-A1 SPIRO[BENZOFURANCYCLOALKANE]CARBOXAMIDES AS 5HT3 ANTAGONISTS RHONE-POULENC RORER INTERNATIONAL (HOLDINGS), INC. (US) 1991-11-14 WO claimed
EP-0430190-A2 New tricyclic compounds SYNTEX (U.S.A.) INC. (US) 1991-06-05 EP claimed
US-4988691-A Analgesics, cardiovascular disorders, nervous system disorders ZAMBON GROUP S.P.A. (IT) 1991-01-29 US claimed
EP-0378111-A1 Isoxazole derivatives having anti-serotonin activity, their preparation process and compositions containing them ZAMBON GROUP S.p.A. (IT) 1990-07-18 EP claimed
EP-0309423-A2 New benzimidazoline-2-oxo-1-carboxylic acid derivatives useful as 5-ht receptor antagonists BOEHRINGER INGELHEIM ITALIA S.p.A. (IT) 1989-03-29 EP claimed