SCHEMBL25373379

SCHEMBL25373379

NC(=O)c1cccc(NC(=O)c2ccc(C(F)(F)F)cc2Oc2ccc(F)cc2Cl)c1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SCN8A Q9UQD0 3/20 0.67
▸ SCN10A Q9Y5Y9 3/20 0.67

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
SCHEMBL30530079 1.00 SCN8A (0.67) SCN8ASCN10A
SCHEMBL20644021 0.93 SCN8A (0.66) SCN8ASCN10A
SCHEMBL13852934 0.92 SCN8A (0.56) SCN8ASCN10A
SCHEMBL30530118 0.89 SCN10A (0.67) SCN8ASCN10A
SCHEMBL29062028 0.89 SCN10A (0.67) SCN8ASCN10A
SCHEMBL31297300 0.88 SCN8A (0.59) SCN8ASCN10A
SCHEMBL20644082 0.88 SCN8A (0.59) SCN8ASCN10A
SCHEMBL20638991 0.88 SCN8A (0.67) SCN8ASCN10A
SCHEMBL30530169 0.88 SCN8A (0.67) SCN8ASCN10A
SCHEMBL20644197 0.86 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023160509-A1 AMIDINE DERIVATIVE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院上海药物研究所 2023-08-31 — — WO disclosed
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
Send feedback