SCHEMBL21075127

SCHEMBL21075127

CC(C)C(C=O)N(C)C(=O)c1cc(C2CC2)c(COc2cc(Cl)cc(OC(F)(F)F)c2)cc1F

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 16/20 0.56
▸ SCN5A Q14524 4/20 0.34
▸ SCN7A Q01118 3/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.32
▸ SCN1A P35498 2/20 0.31
▸ SCN2A Q99250 2/20 0.31
▸ FFAR1 O14842 1/20 0.31
▸ SCN2B O60939 1/20 0.31
▸ SCN4A P35499 1/20 0.31
▸ SCN1B Q07699 1/20 0.31
▸ SCN8A Q9UQD0 1/20 0.31

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
SCHEMBL17423042 0.88 SCN9A (0.56) SCN9ASCN5ASCN7AFFAR4SCN1A
SCHEMBL17423038 0.88 SCN9A (0.56) SCN9ASCN5ASCN7AFFAR4SCN1A
SCHEMBL17428770 0.85 SCN9A (0.54) SCN9ASCN5ASCN7AFFAR4SCN1A
SCHEMBL19064870 0.85 SCN9A (0.54) SCN9ASCN5ASCN7AFFAR4SCN1A
SCHEMBL21075805 0.83 SCN9A (0.63) SCN9ASCN5ASCN7ASCN1ASCN2A
SCHEMBL17428627 0.82 SCN9A (0.67) SCN9ASCN5ASCN7AFFAR4SCN1A
SCHEMBL21075479 0.81 SCN9A (0.53) SCN9ASCN5ASCN7AFFAR4SCN1A
SCHEMBL20697703 0.81 SCN9A (0.58) SCN9ASCN5ASCN7AFFAR4SCN1A
SCHEMBL21075271 0.81 SCN9A (0.66) SCN9ASCN5ASCN7ASCN1ASCN2A
SCHEMBL15543440 0.81 SCN9A (0.68) SCN9ASCN5ASCN7AFFAR4SCN1A

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
EP-3166939-B1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH INC (US) 2019-06-05 — — EP disclosed
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