SCHEMBL21130238

SCHEMBL21130238

O=C(Nc1ccc(CO)nc1)c1cc(C(F)(F)F)ccc1Oc1ccccc1

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SCN8A Q9UQD0 1/20 0.59
▸ SCN10A Q9Y5Y9 1/20 0.59
▸ LRRK2 Q5S007 2/20 0.55
▸ RXFP1 Q9HBX9 1/20 0.53

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
SCHEMBL15561794 0.86 — —
SCHEMBL15561792 0.79 — —
SCHEMBL21130237 0.75 SCN8A (0.54) SCN8ASCN10A
SCHEMBL15561695 0.75 SCN8A (0.63) SCN8ASCN10A
SCHEMBL15917994 0.75 — —
SCHEMBL18083728 0.75 KCNK3 (0.53) RXFP1
SCHEMBL15931112 0.74 — —
SCHEMBL15561733 0.74 SCN8A (1.00) SCN8ASCN10A
SCHEMBL20644110 0.74 SCN8A (0.65) SCN8ASCN10ALRRK2RXFP1
SCHEMBL15561797 0.74 SCN8A (0.64) SCN8ASCN10A

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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