SCHEMBL476696

SCHEMBL476696

CC(NC(=O)CO)Oc1c(C(=O)N2CCC(NCCC(F)(F)F)(C(N)=O)CC2)sc(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 9/20 0.39
CNR2 P34972 2/20 0.37
ALDH1A1 P00352 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL476697 0.87 CNR1 (0.39) CNR1CNR2
SCHEMBL476416 0.86 CNR1 (0.42) CNR1CNR2
SCHEMBL476342 0.85 CNR1 (0.41) CNR1CNR2
SCHEMBL476430 0.82 CNR1 (0.40) CNR1CNR2
SCHEMBL2682366 0.80 CNR1 (0.46) CNR1CNR2
SCHEMBL7902981 0.78 CNR1 (0.40) CNR1CNR2
SCHEMBL2681558 0.76 CNR1 (0.42) CNR1CNR2
SCHEMBL2682922 0.76 CNR1 (0.33) CNR1CNR2
SCHEMBL2681835 0.76 CNR1 (0.39) CNR1CNR2
SCHEMBL2682017 0.76 CNR1 (0.42) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411383-B1 DERIVATIVES OF 3-ALKOXY-4,5-DIARYLTHIOPHENE-2-CARBOXAMIDE, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-10-22 EP claimed
EP-2411383-A1 DERIVATIVES OF 3-ALKOXY-4,5-DIARYLTHIOPHENE-2-CARBOXAMIDE, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-02-01 EP claimed
WO-2010109150-A1 DERIVATIVES OF 3-ALKOXY-4,5-DIARYLTHIOPHENE-2-CARBOXAMIDE, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-09-30 WO claimed