SCHEMBL8552699

SCHEMBL8552699

Cc1ccc(S(=O)(=O)NC(=O)Nc2c(C#N)cnn2-c2ccccc2C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.55
PTGS2 P35354 5/20 0.55
KMT2A Q03164 2/20 0.49
LMNA P02545 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.43
NLRP3 Q96P20 2/20 0.42
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
FBP1 P09467 1/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA4 P22748 2/20 0.41
CA6 P23280 2/20 0.41
CA5A P35218 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA13 Q8N1Q1 2/20 0.41
CA14 Q9ULX7 2/20 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
SCHEMBL8557299 0.90 PTGS1 (0.53) PTGS1PTGS2KMT2ALMNAL3MBTL1
SCHEMBL8555161 0.90 PTGS2 (0.53) PTGS1PTGS2KMT2ALMNAL3MBTL1
SCHEMBL8554620 0.89 PTGS1 (0.52) PTGS1PTGS2KMT2ALMNAL3MBTL1
SCHEMBL8554553 0.88 PTGS2 (0.66) PTGS1PTGS2LMNAL3MBTL1FPR1
SCHEMBL8551389 0.88 PTGS1 (0.51) PTGS1PTGS2KMT2ALMNAL3MBTL1
SCHEMBL8556342 0.86 PTGS2 (0.72) PTGS1PTGS2KMT2ALMNAKDM4E
SCHEMBL8554850 0.84 PTGS2 (0.53) PTGS1PTGS2KMT2ALMNAL3MBTL1
SCHEMBL8552523 0.82 PTGS2 (0.66) PTGS1PTGS2KMT2ALMNAKDM4E
SCHEMBL8553129 0.82 PTGS2 (0.66) PTGS1PTGS2KMT2ALMNAALDH1A1
SCHEMBL8550834 0.82 PTGS2 (0.66) PTGS1PTGS2LMNAALDH1A1SMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

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