SCHEMBL30065546

SCHEMBL30065546

Cc1cc(F)ccc1Cc1cc(C(F)(F)F)ccc1C(=O)Nc1cc[nH]c(=O)c1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 20/20 0.68
SCN10A Q9Y5Y9 19/20 0.68

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
SCHEMBL28661344 1.00 SCN8A (0.68) SCN8ASCN10A
SCHEMBL28668957 0.84 SCN8A (0.54) SCN8ASCN10A
SCHEMBL30065890 0.84 SCN8A (0.54) SCN8ASCN10A
SCHEMBL29919126 0.81 SCN10A (1.00) SCN8ASCN10A
SCHEMBL15561688 0.81 SCN10A (1.00) SCN8ASCN10A
Water SCHEMBL16777902 0.80 SCN10A (0.98) SCN8ASCN10A
SCHEMBL29918864 0.80 SCN10A (1.00) SCN8ASCN10A
SCHEMBL15561761 0.80 SCN10A (1.00) SCN8ASCN10A
SCHEMBL23099925 0.79 SCN10A (0.43) SCN8ASCN10A
SCHEMBL23099928 0.79 LRRK2 (0.56)

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