SCHEMBL20868563

SCHEMBL20868563

CCC(c1cc(Cl)cc(Cl)c1)N1CC(F)(COCc2cc(F)c(C(=O)OC)cc2C2CC2)C1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 17/20 0.43
▸ SCN7A Q01118 4/20 0.37
▸ SCN5A Q14524 4/20 0.37
▸ SCN2B O60939 1/20 0.37
▸ SCN1A P35498 1/20 0.37
▸ SCN4A P35499 1/20 0.37
▸ SCN1B Q07699 1/20 0.37
▸ SCN2A Q99250 1/20 0.37
▸ SCN8A Q9UQD0 1/20 0.37

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
SCHEMBL29028653 1.00 SCN9A (0.43) SCN9ASCN7ASCN5ASCN2BSCN1A
SCHEMBL20868173 0.92 SCN9A (0.44) SCN9ASCN7ASCN5ASCN2BSCN1A
SCHEMBL30512239 0.92 SCN9A (0.44) SCN9ASCN7ASCN5ASCN2BSCN1A
SCHEMBL20868526 0.92 SCN9A (0.35) SCN9ASCN7ASCN5A
SCHEMBL29028677 0.92 SCN9A (0.44) SCN9ASCN7ASCN5ASCN2BSCN1A
SCHEMBL20868206 0.88 SCN9A (0.54) SCN9ASCN7ASCN5ASCN2BSCN1A
SCHEMBL20868256 0.88 SCN9A (0.41) SCN9ASCN7ASCN5ASCN2BSCN1A
SCHEMBL20868297 0.88 SCN9A (0.52) SCN9ASCN7ASCN5ASCN2BSCN1A
SCHEMBL20868542 0.88 SCN9A (0.41) SCN9ASCN7ASCN5ASCN2BSCN1A
SCHEMBL20868301 0.88 SCN9A (0.52) SCN9ASCN7ASCN5ASCN2BSCN1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111212830-B N- (substituted sulfonyl) benzamide derivative and preparation method and medical application thereof 浙江海正药业股份有限公司 2023-07-04 — — CN disclosed
CN-111212830-A N- (substituted sulfonyl) benzamide derivative and preparation method and medical application thereof 浙江海正药业股份有限公司 2020-05-29 — — CN disclosed
WO-2019062848-A1 N-(SUBSTITUTED SULFONYL)BENZAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL USE THEREOF 浙江海正药业股份有限公司 2019-04-04 — — WO disclosed
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