SCHEMBL5330802

SCHEMBL5330802

Cc1c(SCCN(C)C)c2cc(Br)ccc2n1S(=O)(=O)c1ccc(Br)cc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 10/20 0.42
PTGDR2 Q9Y5Y4 5/20 0.36
LMNA P02545 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
PTGDR Q13258 2/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL5329816 0.96 HTR6 (0.41) HTR6PTGDR2
SCHEMBL5420518 0.94 PTGDR2 (0.45) HTR6PTGDR2PTGDR
SCHEMBL5325375 0.94 HTR6 (0.50) HTR6PTGDR2HDAC1HDAC2HDAC6
SCHEMBL5332081 0.92 HTR6 (0.50) HTR6PTGDR2HDAC1HDAC2HDAC6
SCHEMBL5327989 0.92 HTR6 (0.52) HTR6PTGDR2PTGDR
SCHEMBL5328560 0.92 HTR6 (0.48) HTR6PTGDR2LMNAPTGDR
SCHEMBL5331612 0.90 HTR6 (0.56) HTR6PTGDR2PTGDR
SCHEMBL5327669 0.89 HTR6 (0.45) HTR6LMNAHDAC1HDAC2HDAC6
SCHEMBL5407869 0.84 PTGDR2 (0.54) HTR6PTGDR2LMNAPTGDR
SCHEMBL5331698 0.84 HTR6 (0.54) HTR6GAA

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