SCHEMBL31629028

SCHEMBL31629028

COC(=O)c1cc(Cl)c(C)nc1N1CCC(F)(F)CC1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 16/20 0.54
▸ KDM4E B2RXH2 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ OPRK1 P41145 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ OPRM1 P35372 1/20 0.40

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
SCHEMBL31163995 0.95 SCN10A (0.60) SCN10AOPRK1
SCHEMBL25389301 0.95 SCN10A (0.60) SCN10AOPRK1
SCHEMBL25387054 0.89 KDM4E (0.45) SCN10AKDM4EKMT2AOPRK1ALDH1A1
SCHEMBL29256627 0.88 SCN10A (0.53) SCN10AOPRK1
SCHEMBL31343813 0.83 SCN10A (0.62) SCN10AOPRK1
SCHEMBL29256586 0.82 SCN10A (0.48) SCN10AOPRK1
SCHEMBL25391058 0.82 SCN10A (0.60) SCN10A
SCHEMBL29256588 0.81 SCN10A (0.47) SCN10AKDM4EKMT2AOPRK1ALDH1A1
Methyl Benzoate SCHEMBL29256638 0.81 SCN10A (0.54) SCN10A
SCHEMBL31037410 0.81 SCN10A (0.47) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025125666-A1 SUBSTITUTED IMIDAZOLES AS INHIBITORS OF NAV1.8 Grünenthal GmbH (DE) 2025-06-19 — — WO disclosed
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