SCHEMBL8552452

SCHEMBL8552452

N#Cc1cnn(-c2ccccc2)c1NC(=O)NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 10/20 0.62
PTGS2 P35354 10/20 0.62
GFER P55789 1/20 0.49
ALDH1A1 P00352 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
GAA P10253 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KDR P35968 2/20 0.43
FLT1 P17948 1/20 0.43
FLT4 P35916 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
EGFR P00533 1/20 0.41
FGFR1 P11362 1/20 0.41

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 0.92 PTGS1 (0.65) PTGS1PTGS2GFERGAACA12
SCHEMBL8550834 0.90 PTGS2 (0.66) PTGS1PTGS2ALDH1A1KDREGFR
SCHEMBL8554524 0.90 PTGS1 (0.62) PTGS1PTGS2GFERCYP3A4CYP2C9
SCHEMBL8554553 0.90 PTGS2 (0.66) PTGS1PTGS2GFERGAAL3MBTL1
SCHEMBL8553948 0.89 PTGS1 (0.62) PTGS1PTGS2GFER
SCHEMBL8555698 0.87 PTGS1 (0.59) PTGS1PTGS2GFERALDH1A1CA12
SCHEMBL8556342 0.84 PTGS2 (0.72) PTGS1PTGS2GFERALDH1A1SMN1; SMN2
SCHEMBL8554179 0.81 PTGS1 (0.54) PTGS1PTGS2GFERALDH1A1CA12
SCHEMBL1463910 0.81 PTGS1 (0.54) PTGS1PTGS2GFER
SCHEMBL8557299 0.80 PTGS1 (0.53) PTGS1PTGS2ALDH1A1GAAL3MBTL1

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