SCHEMBL476344

SCHEMBL476344

O=C(NC(=O)C1(NCCC(F)(F)F)CCNCC1)c1sc(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)c1OCCCO

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.31
ALPL P05186 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
SCHEMBL476418 0.97 CNR1 (0.32) CNR1
SCHEMBL476386 0.88 CNR1 (0.36) CNR1
SCHEMBL476225 0.87 CNR1 (0.38) CNR1
SCHEMBL476352 0.85 CNR1 (0.37) CNR1
SCHEMBL476391 0.84 CNR1 (0.39) CNR1
SCHEMBL476255 0.83 PTGDR2 (0.34) CNR1
SCHEMBL476316 0.82 CNR1 (0.37) CNR1
SCHEMBL476342 0.82 CNR1 (0.41) CNR1
SCHEMBL476266 0.81 CNR1 (0.36) CNR1
SCHEMBL476375 0.81 CNR1 (0.37) 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
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