SCHEMBL13710482

SCHEMBL13710482

Cc1c(Br)c(C(N)=O)nn1-c1cccc(-c2ccccc2OC(F)(F)F)c1

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.80
SCN10A Q9Y5Y9 2/20 0.63

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
SCHEMBL13710463 0.88 SCN9A (0.65) SCN9ASCN10A
SCHEMBL4505072 0.81 SCN9A (1.00) SCN9ASCN10A
SCHEMBL4489012 0.80 SCN9A (0.67) SCN9ASCN10A
SCHEMBL4491451 0.79 SCN9A (0.70) SCN9ASCN10A
SCHEMBL13710537 0.78 SCN9A (1.00) SCN9ASCN10A
SCHEMBL13710529 0.78 SCN9A (1.00) SCN9ASCN10A
SCHEMBL4498206 0.77 SCN9A (0.70) SCN9ASCN10A
SCHEMBL13710363 0.77 SCN9A (0.74) SCN9ASCN10A
SCHEMBL13710452 0.76 SCN9A (0.84) SCN9ASCN10A
SCHEMBL13710733 0.76 SCN9A (0.83) SCN9ASCN10A

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
US-7589116-B2 Biaryl substituted pyrazoles as sodium channel blockers MERCK & CO. INC. (US) 2009-09-15 US disclosed
US-7589116-B2 Biaryl substituted pyrazoles as sodium channel blockers MERCK & CO. INC. (US) 2009-09-15 US disclosed