SCHEMBL5811121

SCHEMBL5811121

CC(C)(C)CC(C)(C)NC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)c2c1COCC2

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 4/20 0.46
CNR2 P34972 16/20 0.46
CNR1 P21554 15/20 0.46

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
SCHEMBL5811149 0.77 CNR1 (0.59) UGCGCNR2CNR1
SCHEMBL5810507 0.74 CNR2 (0.43) UGCGCNR2CNR1
SCHEMBL5811246 0.72 CNR2 (0.43) CNR2CNR1
SCHEMBL1337792 0.66 CNR2 (0.51) UGCGCNR2CNR1
SCHEMBL1337790 0.66 CNR2 (0.51) UGCGCNR2CNR1
SCHEMBL5796096 0.66 RPA1 (0.42) UGCGCNR2CNR1
SCHEMBL1431548 0.65 CNR1 (0.62) CNR2CNR1
SCHEMBL1337501 0.65 UGCG (0.43) UGCGCNR2CNR1
SCHEMBL1337506 0.65 UGCG (0.43) UGCGCNR2CNR1
SCHEMBL5811700 0.65 CNR2 (0.61) UGCGCNR2CNR1

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
WO-2006030124-A1 CONDENSED PYRAZOLE DERIVATIVES, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME SANOFI-AVENTIS (FR) 2006-03-23 WO claimed