SCHEMBL4181240

SCHEMBL4181240

CCOC(=O)c1cc2c(-c3ccc(Cl)cc3)n(-c3ccccc3Cl)nc2n(CCC(F)(F)F)c1=O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 15/20 0.49
TP53 P04637 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
PDE4B Q07343 2/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
CNR2 P34972 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39

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
SCHEMBL4024702 0.92 CNR1 (0.48) CNR1TP53RXFP1PDE4BCASP1
SCHEMBL4022727 0.89 CHRNA7 (0.42) TP53RXFP1CASP1CASP7
SCHEMBL4020761 0.88 CNR1 (0.45) CNR1TP53RXFP1PDE4BCASP1
SCHEMBL4191527 0.88 CNR1 (0.53) CNR1
SCHEMBL4022474 0.87 CNR1 (0.51) CNR1CNR2
SCHEMBL4020217 0.86 CNR1 (0.49) CNR1CNR2
SCHEMBL4184513 0.83 CNR1 (0.49) CNR1
SCHEMBL4026409 0.82 CNR1 (0.46) CNR1CNR2
SCHEMBL4020673 0.82 CNR1 (0.52) CNR1CNR2
SCHEMBL4192532 0.81 CNR1 (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