SCHEMBL8563053

SCHEMBL8563053

Cc1ccc2c(c1)C(C(=O)N1CCSCC1CN1CCCCC1)CC2=O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 5/20 0.45
UTS2R Q9UKP6 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
THRB P10828 1/20 0.33
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL8560273 0.99 OPRK1 (0.46) OPRK1UTS2RMAPTTHRBHSD17B10
SCHEMBL8566739 0.92 OPRK1 (0.39) OPRK1UTS2RMAPTTHRB
SCHEMBL8558653 0.91 OPRK1 (0.39) OPRK1UTS2RMAPTMEN1POLB
SCHEMBL8561543 0.91 OPRK1 (0.40) OPRK1UTS2RMAPTTHRB
Hydrochloric Acid SCHEMBL8556863 0.90 OPRK1 (0.39) OPRK1UTS2RMAPTTHRB
SCHEMBL8564004 0.88 OPRK1 (0.58) OPRK1UTS2R
SCHEMBL8564299 0.88 OPRK1 (0.40) OPRK1UTS2R
SCHEMBL8560990 0.88 OPRK1 (0.43) OPRK1MEN1KMT2A
SCHEMBL8560543 0.87 OPRK1 (0.59) OPRK1UTS2R
SCHEMBL8560473 0.87 OPRK1 (0.41) OPRK1UTS2R

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