SCHEMBL8562076

SCHEMBL8562076

Cc1ccc2c(c1)CCC2C(=O)N1CCSCC1CN1CCCC1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.36
HRH3 Q9Y5N1 4/20 0.34
KCNH2 Q12809 1/20 0.34
MAPT P10636 1/20 0.34
UTS2R Q9UKP6 2/20 0.34
SRD5A1 P18405 2/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL8563434 0.99 MAPT (0.36) THRBHRH3KCNH2MAPTUTS2R
SCHEMBL8558697 0.95 HRH3 (0.35) THRBHRH3KCNH2MAPTUTS2R
SCHEMBL8556894 0.94 MAPT (0.35) THRBHRH3MAPTUTS2R
SCHEMBL8560472 0.92 THRB (0.36) THRBHRH3KCNH2MAPTUTS2R
SCHEMBL8563224 0.91 MAPT (0.36) THRBHRH3KCNH2MAPTUTS2R
SCHEMBL8559101 0.88 UTS2R (0.42) HRH3UTS2R
SCHEMBL8562129 0.88 HRH3 (0.33) HRH3KCNH2UTS2R
SCHEMBL8560733 0.87 MAPT (0.35) THRBHRH3MAPTUTS2R
SCHEMBL8562827 0.87 MAPT (0.35) THRBHRH3MAPTUTS2R
SCHEMBL8561221 0.87 HRH3 (0.43) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0356247-B1 ANALGESIC CARBOXYLIC ACID AMIDE DERIVATIVES Sankyo Company Limited (JP) 1993-03-17 EP claimed
US-5021413-A Analgesic thiomorpholins their preparation, and pharmaceutical compositions containing them SANKYO COMPANY LIMITED (JP) 1991-06-04 US claimed
EP-0356247-A1 Analgesic carboxylic acid amide derivatives Sankyo Company Limited (JP) 1990-02-28 EP claimed
US-5756730-A Process for preparing analgesic compounds SANKYO COMPANY, LIMITED (JP) 1998-05-26 US disclosed
US-5656758-A AMIDATION OF AN AMINE-CONTAINING THIOMORPHOLINE OR PIPERAZINE COMPOUND SANKYO COMPANY, LIMITED (JP) 1997-08-12 US disclosed
US-5512567-A KAPPA-RECEPTOR AGONISTS SANKYO COMPANY, LIMITED (JP) 1996-04-30 US disclosed
US-5270327-A Piperidine derivatives SANKYO COMPANY, LIMITED (JP) 1993-12-14 US disclosed
EP-0356247-B1 ANALGESIC CARBOXYLIC ACID AMIDE DERIVATIVES Sankyo Company Limited (JP) 1993-03-17 EP disclosed
US-5021413-A Analgesic thiomorpholins their preparation, and pharmaceutical compositions containing them SANKYO COMPANY LIMITED (JP) 1991-06-04 US disclosed
EP-0356247-A1 Analgesic carboxylic acid amide derivatives Sankyo Company Limited (JP) 1990-02-28 EP disclosed