SCHEMBL21130237

SCHEMBL21130237

CC(C)(C)c1ccc(C(=O)Nc2ccc(CO)nc2)c(Oc2ccc(F)cc2)c1

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SCN8A Q9UQD0 8/20 0.54
▸ SCN10A Q9Y5Y9 8/20 0.54
▸ PKM P14618 1/20 0.48

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
SCHEMBL15561877 0.85 P4HTM (0.55) —
SCHEMBL15931116 0.78 SCN8A (0.55) SCN8ASCN10A
SCHEMBL15562019 0.76 SCN8A (0.64) SCN8ASCN10A
SCHEMBL21130238 0.75 SCN8A (0.59) SCN8ASCN10A
SCHEMBL15561753 0.74 SCN8A (0.63) SCN8ASCN10A
SCHEMBL15561822 0.74 — —
SCHEMBL5417842 0.74 — —
SCHEMBL4766809 0.73 DHODH (0.52) SCN8ASCN10A
SCHEMBL9566852 0.73 P4HTM (0.55) —
SCHEMBL15561737 0.72 — —

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-2951155-B1 AMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMA (US) 2019-06-19 — — EP disclosed
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