SCHEMBL28336057

SCHEMBL28336057

CC(Br)(Br)CCCCOc1cc(F)c(C(=O)OC(C)(C)C)cc1C1CC1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 20/20 0.48
▸ SCN5A Q14524 4/20 0.41

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
SCHEMBL28336588 0.91 SCN9A (0.48) SCN9ASCN5A
SCHEMBL30261496 0.81 SCN9A (0.44) SCN9ASCN5A
SCHEMBL16448611 0.81 SCN9A (0.60) SCN9ASCN5A
SCHEMBL16770388 0.80 SCN9A (0.50) SCN9ASCN5A
SCHEMBL17061952 0.80 SCN9A (0.52) SCN9ASCN5A
SCHEMBL15558549 0.79 SCN9A (0.64) SCN9ASCN5A
SCHEMBL16770853 0.79 SCN9A (0.43) SCN9ASCN5A
SCHEMBL16759604 0.79 SCN9A (0.42) SCN9ASCN5A
SCHEMBL17061817 0.79 SCN9A (0.51) SCN9ASCN5A
SCHEMBL16759399 0.79 SCN9A (0.61) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105793238-B Substituted benzamides and methods of use thereof 基因泰克公司 2019-12-24 — — CN disclosed
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