SCHEMBL16242239

SCHEMBL16242239

COc1cccc(Oc2ccc(C(=O)NS(C)(=O)=O)cc2-c2cccnc2OC)c1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 18/20 0.62
▸ SCN5A Q14524 3/20 0.44
▸ SCN2B O60939 1/20 0.44
▸ SCN1A P35498 1/20 0.44
▸ SCN1B Q07699 1/20 0.44
▸ HDAC6 Q9UBN7 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
SCHEMBL16242185 0.93 SCN9A (0.65) SCN9ASCN5AHDAC6
SCHEMBL10154434 0.92 SCN9A (0.67) SCN9ASCN5AHDAC6
SCHEMBL16242206 0.92 SCN9A (0.69) SCN9ASCN5AHDAC6
SCHEMBL16242118 0.92 SCN9A (0.59) SCN9ASCN5A
SCHEMBL16242251 0.92 SCN9A (0.67) SCN9ASCN5A
SCHEMBL16242016 0.91 SCN9A (0.63) SCN9ASCN5A
SCHEMBL16242177 0.90 SCN9A (0.58) SCN9A
SCHEMBL16242186 0.90 SCN9A (0.62) SCN9AHDAC6
SCHEMBL16242154 0.90 SCN9A (0.67) SCN9ASCN5A
SCHEMBL16242187 0.89 SCN9A (0.63) 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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