SCHEMBL30631474

SCHEMBL30631474

Cc1cc(Br)c(N2CCCC(F)(F)CC2)nc1C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MBOAT4 Q96T53 2/20 0.40
▸ SCN10A Q9Y5Y9 14/20 0.39
▸ CNR2 P34972 3/20 0.35

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
SCHEMBL26615699 1.00 MBOAT4 (0.40) MBOAT4SCN10ACNR2
SCHEMBL30593108 0.90 SCN10A (0.41) MBOAT4SCN10A
SCHEMBL26608619 0.90 SCN10A (0.41) MBOAT4SCN10A
SCHEMBL26738490 0.88 SCN10A (0.39) SCN10ACNR2
SCHEMBL31440798 0.86 SCN10A (0.38) MBOAT4SCN10ACNR2
SCHEMBL26615762 0.86 SCN10A (0.38) MBOAT4SCN10ACNR2
SCHEMBL26615787 0.84 ALDH1A1 (0.44) SCN10A
SCHEMBL26615910 0.84 SCN10A (0.39) SCN10ACNR2
SCHEMBL26615749 0.81 SCN10A (0.47) SCN10A
SCHEMBL26738452 0.80 SCN10A (0.41) SCN10ACNR2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119677737-A Heteroaryl compounds for the treatment of pain 沃泰克斯药物股份有限公司 2025-03-21 — — CN disclosed
EP-4511116-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN Vertex Pharmaceuticals Incorporated (US) 2025-02-26 — — EP disclosed
WO-2023205463-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-10-26 — — WO disclosed
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