SCHEMBL19563683

SCHEMBL19563683

Cc1cc(F)ccc1Oc1cccc(C(F)(F)F)c1P

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SCN8A Q9UQD0 6/20 0.40
▸ SCN10A Q9Y5Y9 6/20 0.40
▸ SLC6A4 P31645 1/20 0.39
▸ AR P10275 1/20 0.37
▸ PIK3CD O00329 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ PIK3CB P42338 1/20 0.36
▸ PIK3CG P48736 1/20 0.36

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
SCHEMBL19563614 0.79 SCN8A (0.40) SCN8ASCN10A
SCHEMBL20638673 0.78 MRGPRX4 (0.46) SCN8ASCN10A
SCHEMBL4439280 0.77 SLC6A4 (0.53) SCN8ASCN10ASLC6A4PIK3CDPIK3CA
SCHEMBL20431878 0.75 SCN10A (0.47) SCN8ASCN10ASLC6A4
SCHEMBL26615701 0.73 EPAS1 (0.43) SCN8ASCN10ASLC6A4AR
SCHEMBL26615856 0.73 SCN8A (0.40) SCN8ASCN10ASLC6A4
SCHEMBL19563657 0.73 SCN10A (0.48) SCN8ASCN10A
SCHEMBL4440723 0.73 MEN1 (0.48) SLC6A4ARPIK3CDPIK3CAPIK3CB
SCHEMBL19563717 0.72 AR (0.47) SLC6A4AR
SCHEMBL4446770 0.72 EPAS1 (0.49) SCN8ASCN10ASLC6A4ARPIK3CD

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-3022175-B1 SULFONAMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMA (US) 2017-11-08 — — EP disclosed
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