SCHEMBL28920439

SCHEMBL28920439

O=S(=O)(c1cccc(N2CCNCC2)c1)c1cn(C(F)F)c2ccc(Br)cc12

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.52

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
SCHEMBL30091100 1.00 HTR6 (0.52) HTR6
SCHEMBL28920396 0.89 HTR6 (0.52) HTR6
SCHEMBL28920460 0.88 HTR6 (0.52) HTR6
SCHEMBL30091140 0.88 HTR6 (0.52) HTR6
SCHEMBL28920506 0.87 HTR6 (0.39) HTR6
SCHEMBL30091117 0.87 HTR6 (0.39) HTR6
SCHEMBL28920380 0.85 HTR6 (0.54) HTR6
SCHEMBL30091186 0.85 HTR6 (0.54) HTR6
SCHEMBL30091089 0.82 HTR6 (0.51) HTR6
SCHEMBL28961605 0.82 HTR6 (0.51) HTR6

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-109232362-B Aromatic heterocyclic derivative and application thereof in medicines 广东东阳光药业有限公司 2022-12-27 CN disclosed