SCHEMBL16242041

SCHEMBL16242041

COc1ncccc1-c1cc(C(=O)NS(C)(=O)=O)ccc1Oc1ccc(C(F)(F)F)cc1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 16/20 0.66
▸ SCN5A Q14524 3/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ MRGPRX4 Q96LA9 1/20 0.45
▸ KDR P35968 2/20 0.45
▸ TEK Q02763 2/20 0.45

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
SCHEMBL16242187 0.92 SCN9A (0.63) SCN9ASCN5AMAPTMRGPRX4KDR
SCHEMBL16242066 0.92 SCN9A (0.65) SCN9ASCN5A
SCHEMBL16242206 0.91 SCN9A (0.69) SCN9ASCN5A
SCHEMBL15055743 0.91 SCN9A (0.79) SCN9ASCN5AMRGPRX4KDRTEK
SCHEMBL16242252 0.91 SCN9A (0.66) SCN9ASCN5A
SCHEMBL16242240 0.90 SCN9A (0.59) SCN9ASCN5A
SCHEMBL16242207 0.90 SCN9A (0.67) SCN9AKDM4E
SCHEMBL10154434 0.89 SCN9A (0.67) SCN9ASCN5A
SCHEMBL15054825 0.89 SCN9A (0.81) SCN9ASCN5AMRGPRX4KDRTEK
SCHEMBL16242042 0.89 SCN9A (0.80) 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
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