SCHEMBL8897213

SCHEMBL8897213

CC(O)CNC(=O)C=CC(=O)NCC(C)O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GFPT1 Q06210 1/20 0.44
CNR2 P34972 5/20 0.43
CNR1 P21554 3/20 0.43
PPARG P37231 2/20 0.43
PPARD Q03181 2/20 0.43
PPARA Q07869 2/20 0.43
MAP3K7 O43318 2/20 0.39
TAB1 Q15750 2/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
EPHX2 P34913 1/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 1/20 0.38
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL8895482 1.00 GFPT1 (0.44) GFPT1CNR2CNR1PPARGPPARD
SCHEMBL9570825 0.89 GFPT1 (0.42) GFPT1CNR2CNR1PPARGPPARD
SCHEMBL9570830 0.89 GFPT1 (0.42) GFPT1CNR2CNR1PPARGPPARD
SCHEMBL8648273 0.89 CNR2 (0.47) GFPT1CNR2CNR1PPARGPPARD
SCHEMBL7772177 0.89 CNR2 (0.47) GFPT1CNR2CNR1PPARGPPARD
SCHEMBL29465487 0.83
SCHEMBL7161352 0.82 CNR2 (0.58) GFPT1CNR2CNR1PPARGPPARD
SCHEMBL17267140 0.81
SCHEMBL14901 0.81
SCHEMBL29245397 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5618842-A TREATING DERMATOLOGIC, OPTHALMIC, MUCOSAL, ARTICULAR, CONNECTIVE TISSUE, NERVOUS SYSTEM, ALLERGIC, INFLAMMATORY PATHOLOGIES LIFEGROUP S.P.A. (IT) 1997-04-08 US disclosed