SCHEMBL5331263

SCHEMBL5331263

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

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 10/20 0.44
HTR6 P50406 9/20 0.40
PTGDR Q13258 4/20 0.39
AKR1B1 P15121 1/20 0.36

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
SCHEMBL5333545 0.93 HTR6 (0.41) PTGDR2HTR6
SCHEMBL5407869 0.90 PTGDR2 (0.54) PTGDR2HTR6PTGDR
SCHEMBL5326862 0.90 HTR6 (0.49) PTGDR2HTR6PTGDR
SCHEMBL5326887 0.90 HTR6 (0.40) PTGDR2HTR6PTGDRAKR1B1
SCHEMBL5332248 0.88 HTR6 (0.44) PTGDR2HTR6PTGDR
SCHEMBL5424103 0.88 DDR1 (0.35) PTGDR2HTR6PTGDR
SCHEMBL5420518 0.86 PTGDR2 (0.45) PTGDR2HTR6PTGDR
SCHEMBL5328966 0.86 PTGDR2 (0.55) PTGDR2HTR6PTGDR
SCHEMBL5330910 0.85 HTR6 (0.51) PTGDR2HTR6PTGDR
SCHEMBL5332687 0.84 HTR6 (0.56) PTGDR2HTR6PTGDR

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