SCHEMBL16448552

SCHEMBL16448552

O=C(NS(=O)(=O)C1CC1)c1cc(C2CC2)c(O[C@H]2C3CC4CC2C[C@](F)(C4)C3)cc1F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 20/20 1.00
▸ SCN5A Q14524 4/20 0.64
▸ SCN7A Q01118 1/20 0.64

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
SCHEMBL15537090 0.91 SCN9A (1.00) SCN9ASCN5ASCN7A
SCHEMBL16448562 0.91 SCN9A (1.00) SCN9ASCN5ASCN7A
SCHEMBL16448543 0.90 SCN9A (1.00) SCN9ASCN5ASCN7A
SCHEMBL16435099 0.88 SCN9A (1.00) SCN9ASCN5ASCN7A
SCHEMBL16448553 0.86 SCN9A (1.00) SCN9ASCN5ASCN7A
SCHEMBL16448569 0.86 SCN9A (1.00) SCN9ASCN5ASCN7A
SCHEMBL19064819 0.83 SCN9A (0.72) SCN9ASCN5A
SCHEMBL15558104 0.83 SCN9A (0.72) SCN9ASCN5A
SCHEMBL16448656 0.83 SCN9A (0.72) SCN9ASCN5A
SCHEMBL15558102 0.83 SCN9A (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8952169-B2 N-substituted benzamides and methods of use thereof XENON PHARMACEUTICALS INC. (CA) 2015-02-10 — — US disclosed
US-8952169-B2 N-substituted benzamides and methods of use thereof XENON PHARMACEUTICALS INC. (CA) 2015-02-10 — — US disclosed
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