SCHEMBL7044441

SCHEMBL7044441

CN(C(=O)c1nc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2Cl)n1C)C1CCCCC1

nearest known ligand 0.85

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 16/20 0.85
OPRL1 P41146 2/20 0.56

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
SCHEMBL4076182 0.92 CNR1 (1.00) CNR1OPRL1
SCHEMBL674885 0.81 CNR1 (1.00) CNR1OPRL1
SCHEMBL4427351 0.79 CNR1 (0.66) CNR1OPRL1
SCHEMBL7043234 0.77 CNR1 (0.60) CNR1
SCHEMBL4076015 0.76 CNR1 (1.00) CNR1
SCHEMBL7044597 0.75 CNR1 (0.63) CNR1
SCHEMBL6552429 0.75 CNR1 (0.63) CNR1
SCHEMBL6026096 0.75 CNR1 (0.63) CNR1
SCHEMBL4080087 0.75 CNR1 (0.59) CNR1OPRL1
SCHEMBL7044215 0.74 CNR1 (0.61) 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