SCHEMBL19427304

SCHEMBL19427304

O=C(NSC1CC1)c1cc(C2CC2)c(COc2cc(F)cc(C(F)(F)F)c2)cc1F

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 19/20 0.48
▸ SCN1A P35498 1/20 0.35
▸ SCN4A P35499 1/20 0.35
▸ SCN7A Q01118 1/20 0.35
▸ SCN5A Q14524 1/20 0.35
▸ SCN2A Q99250 1/20 0.35
▸ SCN3A Q9NY46 1/20 0.35
▸ SCN8A Q9UQD0 1/20 0.35

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
SCHEMBL22912716 0.91 SCN9A (0.47) SCN9ASCN1ASCN4ASCN7ASCN5A
SCHEMBL19411381 0.85 SCN9A (0.54) SCN9A
SCHEMBL19411371 0.83 SCN9A (0.54) SCN9ASCN7ASCN5A
SCHEMBL19411416 0.83 SCN9A (0.50) SCN9A
SCHEMBL19430740 0.81 SCN9A (0.68) SCN9ASCN7ASCN5A
SCHEMBL22912689 0.79 SCN9A (0.50) SCN9ASCN5ASCN3A
SCHEMBL20910582 0.73 SCN9A (0.42) SCN9ASCN1ASCN4ASCN7ASCN5A
SCHEMBL19431000 0.73 SCN9A (0.42) SCN9ASCN1ASCN4ASCN7ASCN5A
SCHEMBL16240142 0.70 SCN9A (0.61) SCN9ASCN5A
SCHEMBL17423019 0.67 SCN9A (0.82) SCN9ASCN1ASCN7ASCN5ASCN2A

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
EP-3854782-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF Genentech, Inc. (US) 2021-07-28 — — EP disclosed
EP-3436432-B1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH INC (US) 2021-01-27 — — EP disclosed
WO-2017172802-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-10-05 — — WO disclosed
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