SCHEMBL8561606

SCHEMBL8561606

CN1CCN(C(=O)C2CCCc3cc(Cl)ccc32)C(CN2CCCC2)C1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 6/20 0.40
FNTB P49356 6/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
OPRK1 P41145 5/20 0.40
UTS2R Q9UKP6 3/20 0.39
HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL8562495 0.95 FNTA (0.41) FNTAFNTBMAPTLMNAOPRK1
SCHEMBL8557543 0.88 OPRK1 (0.42) OPRK1UTS2R
SCHEMBL8562664 0.85 CRBN (0.44) OPRK1HRH3
SCHEMBL8559551 0.84 OPRK1 (0.42) MAPTLMNAOPRK1UTS2RHRH3
Hydrochloric Acid SCHEMBL8562242 0.83 OPRK1 (0.42) MAPTLMNAOPRK1UTS2RHRH3
SCHEMBL8558938 0.82 OPRK1 (0.42) OPRK1UTS2R
SCHEMBL8560299 0.82 UTS2R (0.41) OPRK1UTS2RHRH3
Hydrochloric Acid SCHEMBL8556994 0.82 OPRK1 (0.42) OPRK1UTS2R
SCHEMBL8565280 0.81 UTS2R (0.42) MAPTLMNAOPRK1UTS2RHRH3
SCHEMBL8559673 0.80 HRH3 (0.44) OPRK1HRH3

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
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