SCHEMBL14920045

SCHEMBL14920045

Cc1cc(C(=O)N2CC[CH]CC2)cc(-c2ccc(Oc3ccc(F)cc3)cc2)n1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.57

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
SCHEMBL14920078 0.89 SCN9A (0.60) SCN9A
SCHEMBL14934307 0.87 SCN9A (0.58) SCN9A
SCHEMBL14921752 0.84 SCN9A (0.57) SCN9A
SCHEMBL14934322 0.81 SCN9A (0.56) SCN9A
SCHEMBL14919880 0.80 SCN9A (0.64) SCN9A
SCHEMBL14920119 0.79 SCN9A (0.62) SCN9A
SCHEMBL805896 0.79 SCN9A (0.66) SCN9A
SCHEMBL805895 0.78 SCN9A (0.64) SCN9A
SCHEMBL805928 0.74 SCN9A (0.60) SCN9A
SCHEMBL14921899 0.74 SCN9A (0.54) SCN9A

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
WO-2013064884-A1 QUATERNIZED AMINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. (US) 2013-05-10 WO disclosed