SCHEMBL30968462

SCHEMBL30968462

C=CCOc1cc(C23CCC(CNC2)N3C(=O)OC(C)(C)C)cc(F)c1C=C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.33
DPP4 P27487 1/20 0.32
GPR119 Q8TDV5 1/20 0.30

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
SCHEMBL30968488 0.94 SCN9A (0.32) SCN9A
SCHEMBL30968422 0.80
SCHEMBL30968418 0.72
SCHEMBL30968447 0.72
SCHEMBL30968410 0.71 JAK1 (0.40) SCN9ADPP4GPR119
SCHEMBL30741063 0.71 DPP4 (0.39) DPP4GPR119
SCHEMBL20722761 0.71 JAK1 (0.40) SCN9ADPP4GPR119
SCHEMBL30741098 0.71 PSEN1 (0.39) GPR119
SCHEMBL30741108 0.70 HRH3 (0.32) DPP4
SCHEMBL31634911 0.70 RORC (0.41)

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
CN-112867712-B Carboxamide as ubiquitin-specific protease inhibitor 瓦洛早期发现股份有限公司 2024-07-16 CN disclosed