SCHEMBL3359169

SCHEMBL3359169

CCCCCCCC(O)(C(=O)O)c1cccc(Cl)c1

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SCN5A Q14524 3/20 0.78
▸ SCN9A Q15858 3/20 0.78
▸ EPHX1 P07099 3/20 0.45
▸ KIF11 P52732 2/20 0.43
▸ EPHX2 P34913 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL3359165 1.00 SCN5A (0.78) SCN5ASCN9AEPHX1KIF11EPHX2
SCHEMBL1712517 0.88 SCN5A (1.00) SCN5ASCN9AEPHX1KIF11EPHX2
SCHEMBL1712264 0.88 SCN5A (1.00) SCN5ASCN9AEPHX1KIF11EPHX2
SCHEMBL1712454 0.88 SCN5A (1.00) SCN5ASCN9AEPHX1KIF11EPHX2
SCHEMBL10357746 0.85 SCN5A (0.55) SCN5ASCN9AKIF11
SCHEMBL12315579 0.85 SCN5A (0.55) SCN5ASCN9AKIF11
SCHEMBL5155798 0.85 SCN5A (0.55) SCN5ASCN9AKIF11
SCHEMBL8667621 0.85 SCN5A (0.55) SCN5ASCN9AKIF11
SCHEMBL29211112 0.85 SCN5A (0.55) SCN5ASCN9AKIF11
SCHEMBL7916110 0.85 SCN5A (0.55) SCN5ASCN9AKIF11

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-2010027641-A2 NA CHANNELS, DISEASE, AND RELATED ASSAYS AND COMPOSITIONS GEORGETOWN UNIVERSITY (US) 2010-03-11 — — WO disclosed
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