SCHEMBL4027019

SCHEMBL4027019

CCOC(=O)c1cc2c(-c3ccc(Cl)cc3)n(-c3ccc(Cl)cc3Cl)nc2n(CCN(C)C)c1=O

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.46
CNR2 P34972 5/20 0.44
GABRA2 P47869 1/20 0.43
GABRB2 P47870 1/20 0.43

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
SCHEMBL4018799 0.90 RPA1 (0.47) CNR1CNR2
SCHEMBL4021209 0.89 CNR1 (0.47) CNR1CNR2GABRA2GABRB2
SCHEMBL4024237 0.88 KDM4E (0.48) CNR1CNR2GABRA2GABRB2
SCHEMBL4192532 0.88 CNR1 (0.46) CNR1CNR2GABRA2GABRB2
SCHEMBL4018113 0.86 CNR2 (0.46) CNR1CNR2
SCHEMBL4024702 0.84 CNR1 (0.48) CNR1CNR2
SCHEMBL4017898 0.81 RPA1 (0.46) CNR1CNR2
SCHEMBL4181240 0.80 CNR1 (0.49) CNR1CNR2
SCHEMBL4020761 0.79 CNR1 (0.45) CNR1CNR2
SCHEMBL4189580 0.78 CNR2 (0.46) CNR1CNR2

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-2009095752-A1 FUSED PYRAZOLE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS GLENMARK PHARMACEUTICALS, S.A. (US) 2009-08-06 WO disclosed