SCHEMBL18013239

SCHEMBL18013239

CS(=O)(=O)NC(=O)c1cc(Cl)c(OC[C@H]2CCCN2Cc2ccc(Cl)cc2)cc1F

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 19/20 0.64
▸ SCN5A Q14524 2/20 0.60
▸ SCN7A Q01118 1/20 0.60

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
SCHEMBL28383912 1.00 SCN9A (0.64) SCN9ASCN5ASCN7A
SCHEMBL28394643 0.92 SCN9A (0.60) SCN9ASCN5ASCN7A
SCHEMBL28394642 0.92 SCN9A (0.60) SCN9ASCN5ASCN7A
SCHEMBL20668617 0.91 SCN9A (0.60) SCN9ASCN5ASCN7A
SCHEMBL18013114 0.87 SCN9A (0.65) SCN9ASCN5A
SCHEMBL18013238 0.87 HDAC8 (0.47) SCN9ASCN5ASCN7A
SCHEMBL18013379 0.85 SCN9A (0.62) SCN9ASCN5ASCN7A
SCHEMBL28384009 0.85 SCN9A (0.62) SCN9ASCN5ASCN7A
SCHEMBL18013241 0.85 LTA4H (0.46) SCN9ASCN5ASCN7A
SCHEMBL18013117 0.83 SCN9A (0.67) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107406380-B Heterocyclic substituted N-sulfonyl benzamide derivative, preparation method and medical application thereof 上海海雁医药科技有限公司 2020-04-28 — — CN disclosed
CN-107207430-B Heterocyclic substituted N-sulfonyl benzamide derivative, preparation method and medical application thereof 上海海雁医药科技有限公司 2020-04-28 — — CN disclosed
WO-2016124139-A1 HETEROCYCLIC-SUBSTITUTED N-SULFONYLBENZAMIDE DERIVATIVES, PREPARATION METHOD FOR DERIVATIVES, AND PHARMACEUTICAL USE OF DERIVATIVES 上海海雁医药科技有限公司 2016-08-11 — — WO disclosed
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