SCHEMBL29062000

SCHEMBL29062000

CONC(=O)c1cccc(NC(=O)c2ccc(C(F)(F)F)cc2Oc2ccc(F)cc2C)c1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 8/20 0.65
▸ SCN8A Q9UQD0 7/20 0.65

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
SCHEMBL30530053 1.00 SCN10A (0.65) SCN10ASCN8A
SCHEMBL29062028 0.91 SCN10A (0.67) SCN10ASCN8A
SCHEMBL30530118 0.91 SCN10A (0.67) SCN10ASCN8A
SCHEMBL30530124 0.91 SCN10A (0.67) SCN10ASCN8A
SCHEMBL29062010 0.91 SCN10A (0.67) SCN10ASCN8A
SCHEMBL25373823 0.89 SCN10A (0.65) SCN10ASCN8A
SCHEMBL29061993 0.88 SCN10A (0.64) SCN10ASCN8A
SCHEMBL30530082 0.88 SCN10A (0.64) SCN10ASCN8A
SCHEMBL29062019 0.88 SCN10A (0.63) SCN10ASCN8A
SCHEMBL30530142 0.88 SCN10A (0.63) SCN10ASCN8A

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-116655497-A Amidine derivative compound and preparation method and application thereof 中国科学院上海药物研究所 2023-08-29 — — CN disclosed
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