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SCHEMBL5332897

SCHEMBL5332897

COc1ccc(S(=O)(=O)n2c(C)c(SC(C)N(C)C)c3cc(OC)ccc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 18/20 0.51
▸ PTGDR Q13258 1/20 0.45
▸ PTGDR2 Q9Y5Y4 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HTT P42858 1/20 0.41

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
SCHEMBL5331999 0.96 HTR6 (0.51) HTR6PTGDRPTGDR2
SCHEMBL5331610 0.95 HTR6 (0.52) HTR6PTGDRPTGDR2
SCHEMBL5332685 0.94 HTR6 (0.51) HTR6PTGDRPTGDR2
SCHEMBL5327797 0.94 HTR6 (0.49) HTR6PTGDRPTGDR2
SCHEMBL5327986 0.93 HTR6 (0.52) HTR6PTGDRPTGDR2ALDH1A1LMNA
SCHEMBL5330691 0.92 HTR6 (0.46) HTR6PTGDRPTGDR2ALDH1A1LMNA
SCHEMBL5425727 0.92 PTGDR2 (0.56) HTR6PTGDRPTGDR2LMNA
SCHEMBL5328971 0.89 HTR6 (0.48) HTR6PTGDRPTGDR2ALDH1A1LMNA
SCHEMBL5326854 0.89 HTT (0.44) HTR6PTGDRPTGDR2ALDH1A1LMNA
SCHEMBL5329954 0.87 HTR6 (0.49) 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