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SCHEMBL5330893

SCHEMBL5330893

CSc1ccc2c(c1)c(SC(C)N(C)C)c(C)n2S(=O)(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 14/20 0.43
▸ GAA P10253 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ SMN1; SMN2 Q16637 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
SCHEMBL5332244 0.92 HTR6 (0.47) HTR6GAAHPGDALDH1A1L3MBTL1
SCHEMBL5331697 0.89 HTR6 (0.55) HTR6GAAHPGDALDH1A1L3MBTL1
SCHEMBL5333170 0.88 HTR6 (0.54) HTR6GAAHPGDALDH1A1L3MBTL1
SCHEMBL5328011 0.88 HTR6 (0.52) HTR6GAAHPGDALDH1A1L3MBTL1
SCHEMBL5330895 0.83 HTR6 (0.41) HTR6GAAHPGDALDH1A1L3MBTL1
SCHEMBL5330909 0.83 HTR6 (0.52) HTR6
SCHEMBL5325197 0.83 HTR6 (0.52) HTR6L3MBTL1SMN1; SMN2
SCHEMBL5333542 0.81 MAPT (0.39) HTR6GAAALDH1A1SMN1; SMN2
SCHEMBL5331426 0.81 HTR6 (0.43) HTR6
SCHEMBL5331261 0.80 PTGDR2 (0.42) 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 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