SCHEMBL30065550

SCHEMBL30065550

O=C(Nc1cc[nH]c(=O)c1)c1cc(Cl)c(C(F)(F)F)cc1Cc1ccc(F)cc1C1CC1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 19/20 0.49
SCN10A Q9Y5Y9 19/20 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
SCHEMBL28658960 1.00 SCN8A (0.49) SCN8ASCN10A
SCHEMBL30065545 0.87 SCN8A (0.53) SCN8ASCN10A
SCHEMBL28654766 0.87 SCN8A (0.53) SCN8ASCN10A
SCHEMBL28668957 0.86 SCN8A (0.54) SCN8ASCN10A
SCHEMBL30065890 0.86 SCN8A (0.54) SCN8ASCN10A
SCHEMBL28676673 0.84 SCN8A (0.61) SCN8ASCN10A
SCHEMBL30065659 0.84 SCN8A (0.61) SCN8ASCN10A
SCHEMBL22941962 0.83 SCN8A (0.62) SCN8ASCN10A
SCHEMBL30065587 0.82 SCN8A (0.54) SCN8ASCN10A
SCHEMBL30065551 0.80 SSTR5 (0.41)

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
CN-112996774-B 2-oxo-1,2-dihydropyridine derivative, preparation method and application thereof in medicine 江苏恒瑞医药股份有限公司 2022-11-22 CN disclosed