SCHEMBL16242187

SCHEMBL16242187

COc1ncccc1-c1cc(C(=O)NS(C)(=O)=O)ccc1Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 12/20 0.63
▸ P2RY1 P47900 3/20 0.47
▸ MRGPRX4 Q96LA9 1/20 0.45
▸ SCN5A Q14524 2/20 0.44
▸ KDR P35968 1/20 0.43
▸ TEK Q02763 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL16242041 0.92 SCN9A (0.66) SCN9AMRGPRX4SCN5AKDRTEK
SCHEMBL16242240 0.90 SCN9A (0.59) SCN9ASCN5A
SCHEMBL16242016 0.90 SCN9A (0.63) SCN9ASCN5AKDRTEK
SCHEMBL16242239 0.89 SCN9A (0.62) SCN9ASCN5A
SCHEMBL16242118 0.88 SCN9A (0.59) SCN9ASCN5A
SCHEMBL10154434 0.87 SCN9A (0.67) SCN9ASCN5A
SCHEMBL16242251 0.86 SCN9A (0.67) SCN9ASCN5A
SCHEMBL16242218 0.86 SCN9A (0.70) SCN9ASCN5A
SCHEMBL16242185 0.86 SCN9A (0.65) SCN9ASCN5A
SCHEMBL16242066 0.86 SCN9A (0.65) SCN9ASCN5A

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-2593433-B1 N-SULFONYLBENZAMIDES AS INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS PFIZER LTD (GB) 2014-11-26 — — EP disclosed
Send feedback