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SCHEMBL5330895

SCHEMBL5330895

CSc1ccc2c(c1)c(SCCN(C)C)c(C)n2S(=O)(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 14/20 0.41
▸ GAA P10253 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PTGDR Q13258 1/20 0.35
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ PKM P14618 1/20 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
SCHEMBL5332248 0.92 HTR6 (0.44) HTR6GAAHPGDALDH1A1L3MBTL1
SCHEMBL5331698 0.88 HTR6 (0.54) HTR6GAAHPGDALDH1A1L3MBTL1
SCHEMBL5333172 0.88 HTR6 (0.54) HTR6GAAHPGDALDH1A1L3MBTL1
SCHEMBL5328013 0.88 HTR6 (0.51) HTR6GAAHPGDALDH1A1L3MBTL1
SCHEMBL5328058 0.87 HTR6 (0.49) HTR6PTGDRPTGDR2
SCHEMBL5330910 0.83 HTR6 (0.51) HTR6PTGDRPTGDR2
SCHEMBL5325199 0.83 HTR6 (0.51) HTR6PTGDR2
SCHEMBL5330893 0.83 HTR6 (0.43) HTR6GAAHPGDALDH1A1L3MBTL1
SCHEMBL5333545 0.81 HTR6 (0.41) HTR6ALDH1A1PTGDR2PKM
SCHEMBL5331263 0.81 PTGDR2 (0.44) HTR6PTGDRPTGDR2

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-2007020653-A1 THIOETHER DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2007-02-22 — — WO claimed
WO-2007020653-A1 THIOETHER DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2007-02-22 — — WO disclosed