SCHEMBL3236935

SCHEMBL3236935

CC(=O)Nc1cc(Nc2ncnc(N3CCC(c4ccccc4)CC3)n2)ccc1F

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 20/20 0.75
▸ KCNH2 Q12809 1/20 0.49
▸ SCN5A Q14524 1/20 0.49

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
SCHEMBL3250195 0.89 SCN9A (0.64) SCN9A
SCHEMBL3241081 0.87 SCN9A (0.77) SCN9AKCNH2SCN5A
SCHEMBL3240538 0.86 SCN9A (1.00) SCN9AKCNH2SCN5A
SCHEMBL3244474 0.85 SCN9A (0.77) SCN9AKCNH2SCN5A
SCHEMBL3116491 0.85 SCN9A (0.78) SCN9AKCNH2SCN5A
SCHEMBL3244576 0.84 SCN9A (0.81) SCN9AKCNH2SCN5A
SCHEMBL3247036 0.84 SCN9A (0.65) SCN9AKCNH2SCN5A
SCHEMBL3125761 0.82 SCN9A (0.84) SCN9AKCNH2SCN5A
SCHEMBL3124030 0.81 SCN9A (0.62) SCN9AKCNH2SCN5A
SCHEMBL3243244 0.81 SCN9A (0.53) SCN9AKCNH2SCN5A

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
WO-2010022055-A2 INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS AMGEN INC. (US) 2010-02-25 — — WO claimed
WO-2010022055-A2 INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS AMGEN INC. (US) 2010-02-25 — — WO disclosed
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