SCHEMBL8553948

SCHEMBL8553948

CC(C)c1ccc(S(=O)(=O)NC(=O)Nc2c(C#N)cnn2-c2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 8/20 0.62
PTGS2 P35354 8/20 0.62
GFER P55789 1/20 0.47
USP2 O75604 1/20 0.42
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
FPR1 P21462 5/20 0.41
NPBWR1 P48145 1/20 0.39
MCHR1 Q99705 1/20 0.39
LMNA P02545 1/20 0.39
NLRP3 Q96P20 1/20 0.38
CNKSR1 Q969H4 1/20 0.38

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
SCHEMBL8551424 0.90 PTGS1 (0.65) PTGS1PTGS2GFERNPSR1FPR1
SCHEMBL8554524 0.89 PTGS1 (0.62) PTGS1PTGS2GFERNPSR1LMNA
SCHEMBL8552452 0.89 PTGS1 (0.62) PTGS1PTGS2GFER
SCHEMBL8554553 0.89 PTGS2 (0.66) PTGS1PTGS2GFERFPR1LMNA
SCHEMBL8555698 0.84 PTGS1 (0.59) PTGS1PTGS2GFERMAPT
SCHEMBL8556342 0.83 PTGS2 (0.72) PTGS1PTGS2GFERFPR1LMNA
SCHEMBL8552895 0.82 FPR1 (0.48) PTGS1PTGS2MAPTNPSR1FPR1
SCHEMBL8550834 0.81 PTGS2 (0.66) PTGS1PTGS2MAPTFPR1LMNA
SCHEMBL8552523 0.81 PTGS2 (0.66) PTGS1PTGS2GFERFPR1LMNA
SCHEMBL8554179 0.81 PTGS1 (0.54) PTGS1PTGS2GFERFPR1CNKSR1

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