SCHEMBL7044693

SCHEMBL7044693

O=C(NC1CCCCC1)c1nc(-c2ccc(Cl)cc2)c(CCc2ccc(Cl)cc2Cl)[nH]1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 17/20 0.64

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
SCHEMBL7043236 0.92 CNR1 (0.64) CNR1
SCHEMBL7043337 0.83 CNR1 (0.56) CNR1
SCHEMBL7048167 0.82 CNR1 (0.64) CNR1
SCHEMBL7044205 0.82 CNR1 (0.52) CNR1
SCHEMBL7043451 0.80 CNR1 (0.55) CNR1
SCHEMBL4076020 0.79 CNR1 (1.00) CNR1
SCHEMBL7045579 0.78 CNR1 (0.57) CNR1
SCHEMBL6552432 0.78 CNR1 (0.57) CNR1
SCHEMBL7041235 0.78 CNR1 (0.55) CNR1
SCHEMBL7044217 0.77 CNR1 (0.57) 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 2 patents. 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 claimed
WO-2003007887-A2 SUBSTITUTED IMIDAZOLES AS CANNABINOID RECEPTOR MODULATORS MERCK & CO., INC. (US) 2003-01-30 WO disclosed