SCHEMBL12288702

SCHEMBL12288702

Cc1c(C(=O)NN2CCCC2)nc(-c2ccc(Cl)cc2Cl)n1-c1ccc(C#N)cc1

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 20/20 0.84
CNR2 P34972 15/20 0.84

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
SCHEMBL2633192 0.99 CNR1 (0.84) CNR1CNR2
SCHEMBL4508279 0.91 CNR1 (1.00) CNR1CNR2
SCHEMBL675659 0.90 CNR1 (1.00) CNR1CNR2
SCHEMBL4511060 0.90 CNR1 (1.00) CNR1CNR2
Dimethylamine SCHEMBL1041936 0.89 CNR1 (0.96) CNR1CNR2
SCHEMBL3079640 0.88 CNR1 (0.90) CNR1CNR2
SCHEMBL12064355 0.88 CNR1 (0.80) CNR1CNR2
SCHEMBL10144577 0.88 CNR1 (0.85) CNR1CNR2
SCHEMBL2633161 0.87 CNR1 (0.73) CNR1CNR2
SCHEMBL31528984 0.87 CNR1 (0.73) 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
EP-2368881-A1 Heteropyrazole analogs acting on cannabinoid receptors University of Connecticut (US) 2011-09-28 EP disclosed