SCHEMBL9703285

SCHEMBL9703285

CCN(CCCOS(=O)(=O)c1ccc(C)cc1)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.52
MAOB P27338 6/20 0.47
OPRM1 P35372 1/20 0.47
OPRK1 P41145 1/20 0.47
BCHE P06276 3/20 0.46
ACHE P22303 3/20 0.46
CNR2 P34972 6/20 0.46
CNR1 P21554 1/20 0.45

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
SCHEMBL14192202 0.92 MCHR1 (0.55) MCHR1MAOBOPRM1OPRK1CNR2
SCHEMBL6872283 0.85 MCHR1 (0.58) MCHR1BCHEACHECNR2CNR1
SCHEMBL30379861 0.85 ATM (0.50) MCHR1MAOBCNR2
SCHEMBL16930318 0.84 MCHR1 (0.51) MCHR1OPRK1CNR2
SCHEMBL5743428 0.83 MAOB (0.51) MAOBOPRM1BCHEACHE
SCHEMBL4022611 0.80 MEN1 (0.51) MCHR1MAOBACHECNR2
SCHEMBL7028389 0.78 CNR2 (0.50) MCHR1BCHEACHECNR2
SCHEMBL5745728 0.78 MCHR1 (0.52) MCHR1MAOBOPRM1OPRK1BCHE
SCHEMBL2310681 0.77 FKBP1A (0.51) MCHR1BCHEACHECNR2
SCHEMBL11438901 0.76 CA12 (0.51) CNR2CNR1

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-5086051-A 1H, 3H-pyrrolo[1,2-c]thiazole-7-carboxamide derivatives and pharmaceutical compositions containing them RHONE-POULENC SANTE (FR) 1992-02-04 US disclosed