SCHEMBL16618532

SCHEMBL16618532

Cc1cc(C(=O)NS(C)(=O)=O)ccc1-c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 12/20 0.60
SCN2B O60939 4/20 0.53
SCN1B Q07699 4/20 0.53
SCN5A Q14524 3/20 0.53
SCN1A P35498 3/20 0.53
P4HTM Q9NXG6 2/20 0.48
ESR2 Q92731 1/20 0.46
PTGS2 P35354 1/20 0.45
PTPN1 P18031 1/20 0.44
ROCK2 O75116 1/20 0.44
ROCK1 Q13464 1/20 0.44

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
SCHEMBL16618535 0.82 SCN9A (0.52) SCN9ASCN2BSCN1BSCN5ASCN1A
SCHEMBL31331542 0.79 SCN9A (0.64) SCN9AP4HTMPTPN1
SCHEMBL17946819 0.78 SCN9A (0.57) SCN9ASCN5A
Hydrochloric Acid SCHEMBL5704194 0.78 SCN9A (0.54) SCN9A
SCHEMBL16600419 0.78 ROCK1 (0.59) ROCK2ROCK1
SCHEMBL29707122 0.77 ESR2 (0.58) ESR2PTPN1
SCHEMBL121338 0.77 ESR2 (0.58) ESR2PTPN1
SCHEMBL17946822 0.77 SCN9A (0.67) SCN9ASCN5A
Hydrochloric Acid SCHEMBL16600645 0.77 ROCK1 (0.58) ROCK2ROCK1
SCHEMBL438531 0.77 PTPRC (0.59) ESR2ROCK2ROCK1

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
WO-2015051043-A1 BIARYL ACYL-SULFONAMIDE COMPOUNDS AS SODIUM CHANNEL INHIBITORS AMGEN INC. (US) 2015-04-09 WO disclosed