SCHEMBL9215229

SCHEMBL9215229

NC(=O)N(O)C1CCc2cc(OCc3cc(F)ccc3F)ccc21

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN3A Q9NY46 3/20 0.53
KCNH2 Q12809 1/20 0.44

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
SCHEMBL9220961 0.92 SCN3A (0.51) SCN3AKCNH2
SCHEMBL9223074 0.89 SCN3A (0.64) SCN3AKCNH2
SCHEMBL9215988 0.86 MAOB (0.46) KCNH2
SCHEMBL9216059 0.84 SCN3A (0.45) SCN3A
SCHEMBL9213857 0.84 SCN3A (0.51) SCN3AKCNH2
SCHEMBL9597053 0.80 ALOX5 (0.54)
SCHEMBL9216048 0.80 SCN3A (0.47) SCN3A
SCHEMBL9217208 0.80 MAOB (0.51) SCN3AKCNH2
SCHEMBL9215265 0.80 LIPG (0.49)
SCHEMBL9597496 0.79 ALOX5 (0.42)

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-1995002575-A1 5-LIPOXYGENASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1995-01-26 WO disclosed