SCHEMBL5331999

SCHEMBL5331999

COc1ccc2c(c1)c(SC(C)N(C)C)c(C)n2S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 17/20 0.51
PTGDR Q13258 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.42
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL5332897 0.96 HTR6 (0.51) HTR6PTGDRPTGDR2
SCHEMBL5331610 0.93 HTR6 (0.52) HTR6PTGDRPTGDR2
SCHEMBL5332685 0.92 HTR6 (0.51) HTR6PTGDRPTGDR2
SCHEMBL5327797 0.92 HTR6 (0.49) HTR6PTGDRPTGDR2
SCHEMBL5327986 0.89 HTR6 (0.52) HTR6PTGDRPTGDR2
SCHEMBL5330691 0.88 HTR6 (0.46) HTR6PTGDRPTGDR2MAPT
SCHEMBL5425727 0.88 PTGDR2 (0.56) HTR6PTGDRPTGDR2
SCHEMBL5329812 0.86 HTR6 (0.43) HTR6PTGDR2POLBMAPT
SCHEMBL5326854 0.85 HTT (0.44) HTR6PTGDRPTGDR2POLBMAPT
SCHEMBL5329954 0.85 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 1 patent. 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 disclosed