SCHEMBL29256688

SCHEMBL29256688

CC(C)c1nc(N2CCCC(F)(F)CC2)c(C(=O)O)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 18/20 0.47
▸ AKT1 P31749 2/20 0.38
▸ AKT2 P31751 2/20 0.38
▸ AKT3 Q9Y243 2/20 0.38

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
SCHEMBL25391058 0.86 SCN10A (0.60) SCN10A
SCHEMBL29256657 0.83 SCN10A (0.47) SCN10A
SCHEMBL26615889 0.83 SCN10A (0.47) SCN10A
SCHEMBL31343740 0.83 SCN10A (0.60) SCN10A
SCHEMBL31037395 0.83 SCN10A (0.53) SCN10A
SCHEMBL31037406 0.82 SCN10A (0.45) SCN10A
SCHEMBL31163991 0.82 SCN10A (0.45) SCN10A
SCHEMBL21906178 0.81 SCN10A (0.64) SCN10A
SCHEMBL31345669 0.81 SCN10A (0.44) SCN10A
SCHEMBL26618095 0.81 SCN10A (0.44) SCN10A

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-2024217344-A1 NAV1.8 INHIBITORS, PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院上海药物研究所 2024-10-24 — — WO disclosed
CN-118324743-A Nav1.8 inhibitor and preparation method and application thereof 中国科学院上海药物研究所 2024-07-12 — — CN disclosed
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