SCHEMBL19971366

SCHEMBL19971366

CNC(=O)OCc1cn(S(=O)(=O)c2cccc(F)c2)c2cc(Br)cnc12

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 15/20 0.41
DRD2 P14416 1/20 0.39
BRD4 O60885 2/20 0.38
IDE P14735 1/20 0.36
PTGDR Q13258 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
HTR2A P28223 1/20 0.33

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
SCHEMBL16618636 0.84 HTR6 (0.46) HTR6DRD2BRD4IDEPTGDR
SCHEMBL19971353 0.84 HTR6 (0.41) HTR6DRD2BRD4IDEPTGDR
SCHEMBL19971361 0.82 HTR6 (0.36) HTR6DRD2BRD4IDEPTGDR
SCHEMBL16618600 0.80 HTR6 (0.42) HTR6DRD2BRD4IDEPTGDR
SCHEMBL16626658 0.78 HTR6 (0.39) HTR6DRD2BRD4IDEPTGDR
SCHEMBL19971354 0.78 HTR6 (0.38) HTR6DRD2IDEPTGDRPTGDR2
SCHEMBL19971348 0.74 HTR6 (0.36) HTR6DRD2IDEHTR2A
SCHEMBL16619422 0.74 HTR6 (0.44) HTR6DRD2BRD4
SCHEMBL19971426 0.73 RORC (0.45) HTR6BRD4
SCHEMBL19971533 0.72 HTR6 (0.39) HTR6IDEPTGDRPTGDR2HTR2A

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
EP-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP claimed
EP-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP disclosed