SCHEMBL8558296

SCHEMBL8558296

O=C1CC(C(=O)N2CCOCC2CN2CCCC2)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 2/20 0.48
UTS2R Q9UKP6 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTR2C P28335 3/20 0.38
HRH3 Q9Y5N1 4/20 0.37
GLS O94925 1/20 0.37
METAP1 P53582 2/20 0.37
MAPK1 P28482 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
Hydrochloric Acid SCHEMBL8558540 0.99 OPRK1 (0.48) OPRK1UTS2RL3MBTL1MEN1KMT2A
SCHEMBL8562238 0.89 UTS2R (0.42) OPRK1UTS2RL3MBTL1HRH3METAP1
SCHEMBL8559617 0.86 UTS2R (0.44) OPRK1UTS2RMEN1KMT2A
Hydrochloric Acid SCHEMBL8565651 0.85 UTS2R (0.43) OPRK1UTS2RMEN1KMT2A
SCHEMBL8562893 0.85 UTS2R (0.54) OPRK1UTS2RHRH3
Hydrochloric Acid SCHEMBL8561921 0.85 UTS2R (0.53) OPRK1UTS2RHRH3
SCHEMBL8559237 0.84 OPRK1 (0.52) OPRK1HRH3KCNH2
Hydrochloric Acid SCHEMBL8558023 0.83 OPRK1 (0.51) OPRK1HRH3KCNH2
SCHEMBL8559450 0.83 OPRK1 (0.51) OPRK1HRH3KCNH2
SCHEMBL8562223 0.83 UTS2R (0.46) OPRK1UTS2RHRH3

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