SCHEMBL31037376

SCHEMBL31037376

COC(=O)c1cc(Cl)c(CF)nc1N1CCCC(F)(F)CC1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 19/20 0.47
▸ OPRK1 P41145 1/20 0.37

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
SCHEMBL29256586 0.93 SCN10A (0.48) SCN10AOPRK1
SCHEMBL31037410 0.92 SCN10A (0.47) SCN10AOPRK1
SCHEMBL29256635 0.92 SCN10A (0.47) SCN10AOPRK1
SCHEMBL31037406 0.87 SCN10A (0.45) SCN10A
SCHEMBL25389301 0.86 SCN10A (0.60) SCN10AOPRK1
SCHEMBL31163995 0.86 SCN10A (0.60) SCN10AOPRK1
SCHEMBL31343813 0.85 SCN10A (0.62) SCN10AOPRK1
SCHEMBL29256627 0.83 SCN10A (0.53) SCN10AOPRK1
SCHEMBL21905978 0.82 SCN10A (0.63) SCN10AOPRK1
SCHEMBL21906100 0.82 SCN10A (0.60) SCN10AOPRK1

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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