SCHEMBL8551424

SCHEMBL8551424

N#Cc1cnn(-c2ccccc2)c1NC(=O)NS(=O)(=O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 8/20 0.65
PTGS2 P35354 8/20 0.65
GFER P55789 1/20 0.53
FPR1 P21462 1/20 0.43
CNKSR1 Q969H4 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
NLRP3 Q96P20 1/20 0.41
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
XDH P47989 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
SCHEMBL8554524 0.92 PTGS1 (0.62) PTGS1PTGS2GFERCNKSR1CA12
SCHEMBL8552452 0.92 PTGS1 (0.62) PTGS1PTGS2GFERCA12CA1
SCHEMBL8554553 0.92 PTGS2 (0.66) PTGS1PTGS2GFERFPR1GAA
SCHEMBL8553948 0.90 PTGS1 (0.62) PTGS1PTGS2GFERFPR1CNKSR1
SCHEMBL8555698 0.90 PTGS1 (0.59) PTGS1PTGS2GFERCA12CA1
SCHEMBL8556342 0.86 PTGS2 (0.72) PTGS1PTGS2GFERFPR1
SCHEMBL8554179 0.86 PTGS1 (0.54) PTGS1PTGS2GFERFPR1CNKSR1
SCHEMBL8552523 0.82 PTGS2 (0.66) PTGS1PTGS2GFERFPR1CA12
SCHEMBL8553129 0.82 PTGS2 (0.66) PTGS1PTGS2GFERFPR1
SCHEMBL8550834 0.82 PTGS2 (0.66) PTGS1PTGS2FPR1

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-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP claimed
EP-0885890-A1 SULFONYLUREIDOPYRAZOLE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-12-23 EP disclosed