SCHEMBL28068049

SCHEMBL28068049

COC(=O)NCc1cn(S(=O)(=O)c2cccc(F)c2)c2nc(Nc3ccc(Cl)nc3Cl)ccc12

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.35
IDE P14735 1/20 0.35
TRPA1 O75762 1/20 0.34
EPHX2 P34913 2/20 0.34
PPARG P37231 2/20 0.34
FBP1 P09467 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.33
HTR2A P28223 1/20 0.32
FGFR4 P22455 1/20 0.32
DRD2 P14416 1/20 0.31
PTGDR Q13258 1/20 0.30
PTGDR2 Q9Y5Y4 1/20 0.30

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
SCHEMBL16626801 0.90 HTR6 (0.36) HTR6IDESMN1; SMN2MAPTHTR2A
Hydrochloric Acid SCHEMBL16619116 0.90 HTR6 (0.35) HTR6IDESMN1; SMN2MAPTHTR2A
SCHEMBL19971351 0.88 HTR6 (0.33) HTR6IDEFBP1SMN1; SMN2HTR2A
SCHEMBL16618986 0.86 HDAC1 (0.34) HTR6IDEEPHX2PPARGSMN1; SMN2
SCHEMBL19971350 0.85 IDE (0.35) HTR6IDE
SCHEMBL16626800 0.84 HDAC1 (0.33) HTR6IDEHTR2A
SCHEMBL16626788 0.76 HTR6 (0.39) HTR6IDEHTR2AFGFR4DRD2
SCHEMBL17971552 0.76 HTR6 (0.41) HTR6IDEFBP1HTR2AFGFR4
Hydrochloric Acid SCHEMBL16619073 0.75 HTR6 (0.38) HTR6IDEHTR2AFGFR4DRD2
Hydrochloric Acid SCHEMBL16619279 0.75 HTR6 (0.41) HTR6IDEFBP1HTR2AFGFR4

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
CN-105612150-A Sulfonylindole derivatives and process for producing the same DAE WOONG PHARMA 2016-05-25 CN claimed
CN-105612150-A Sulfonylindole derivatives and process for producing the same DAE WOONG PHARMA 2016-05-25 CN disclosed