SCHEMBL28024939

SCHEMBL28024939

CC(C)(C)OOC(=O)c1cc(C2CC2)c(CO)cc1F

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 20/20 0.41
▸ SCN5A Q14524 2/20 0.36
▸ SCN7A Q01118 1/20 0.36

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
SCHEMBL28078961 0.89 SCN9A (0.41) SCN9ASCN5ASCN7A
SCHEMBL15599202 0.87 SCN9A (0.43) SCN9ASCN5ASCN7A
SCHEMBL21075309 0.78 SCN9A (0.44) SCN9ASCN5ASCN7A
SCHEMBL15544613 0.77 SCN9A (0.46) SCN9ASCN5ASCN7A
SCHEMBL16759482 0.76 SCN9A (0.42) SCN9ASCN5ASCN7A
SCHEMBL16771098 0.76 SCN9A (0.42) SCN9ASCN5ASCN7A
SCHEMBL17061758 0.71 SCN9A (0.48) SCN9ASCN5ASCN7A
SCHEMBL28542639 0.71 SCN9A (0.39) SCN9ASCN5ASCN7A
SCHEMBL20868186 0.71 SCN9A (0.66) SCN9ASCN5ASCN7A
SCHEMBL16770853 0.71 SCN9A (0.43) SCN9ASCN5ASCN7A

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
CN-105793238-A Substituted benzamides and methods of use thereof 基因泰克公司 2016-07-20 — — CN disclosed
CN-104797555-A N-substituted benzamides and methods of use thereof GENENTECH INC 2015-07-22 — — CN disclosed
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