SCHEMBL16448654

SCHEMBL16448654

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

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 20/20 0.68
▸ SCN5A Q14524 1/20 0.50

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
SCHEMBL16448657 1.00 SCN9A (0.68) SCN9ASCN5A
SCHEMBL15559036 1.00 SCN9A (0.68) SCN9ASCN5A
SCHEMBL15558660 1.00 SCN9A (0.68) SCN9ASCN5A
SCHEMBL15535849 1.00 SCN9A (0.68) SCN9ASCN5A
SCHEMBL16449074 0.90 SCN9A (0.55) SCN9ASCN5A
SCHEMBL16448632 0.89 SCN9A (0.69) SCN9ASCN5A
SCHEMBL16448653 0.86 SCN9A (0.67) SCN9ASCN5A
SCHEMBL15536732 0.86 SCN9A (0.67) SCN9ASCN5A
SCHEMBL15557687 0.86 SCN9A (0.67) SCN9ASCN5A
SCHEMBL15557688 0.86 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 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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