SCHEMBL7044590

SCHEMBL7044590

CNC(=O)c1nc(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 18/20 0.49
SCN10A Q9Y5Y9 1/20 0.44
CNR2 P34972 2/20 0.44

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
SCHEMBL13722556 0.84 CDC7 (0.46) CNR1CNR2
SCHEMBL4084159 0.81 CNR1 (0.78) CNR1CNR2
SCHEMBL7044435 0.79 CNR1 (0.49) CNR1CNR2
SCHEMBL6552039 0.78 CNR1 (0.47) CNR1CNR2
SCHEMBL7041731 0.77 CNR1 (0.47) CNR1CNR2
SCHEMBL6552000 0.76 CNR1 (0.47) CNR1CNR2
SCHEMBL7044215 0.76 CNR1 (0.61) CNR1
SCHEMBL7044597 0.75 CNR1 (0.63) CNR1
SCHEMBL7046656 0.75 CNR1 (0.52) CNR1
SCHEMBL6552429 0.75 CNR1 (0.63) CNR1

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-2003007887-A2 SUBSTITUTED IMIDAZOLES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-01-30 WO disclosed