SCHEMBL8554850

SCHEMBL8554850

Cc1ccc(S(=O)(=O)NC(=O)Nc2c(C#N)cnn2-c2ccccn2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.53
PTGS1 P23219 4/20 0.53
FPR1 P21462 1/20 0.51
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 2/20 0.42
FBP1 P09467 1/20 0.42
KDM4E B2RXH2 2/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 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
SCHEMBL8554553 0.86 PTGS2 (0.66) PTGS2PTGS1FPR1LMNAL3MBTL1
SCHEMBL8556342 0.85 PTGS2 (0.72) PTGS2PTGS1FPR1LMNASMN1; SMN2
SCHEMBL8552699 0.84 PTGS1 (0.55) PTGS2PTGS1FPR1LMNASMN1; SMN2
SCHEMBL8555161 0.83 PTGS2 (0.53) PTGS2PTGS1FPR1LMNASMN1; SMN2
SCHEMBL8557299 0.83 PTGS1 (0.53) PTGS2PTGS1FPR1LMNASMN1; SMN2
SCHEMBL8554620 0.81 PTGS1 (0.52) PTGS2PTGS1FPR1LMNASMN1; SMN2
SCHEMBL8551988 0.81 PTGS2 (0.73) PTGS2PTGS1FPR1LMNASMN1; SMN2
SCHEMBL8553129 0.80 PTGS2 (0.66) PTGS2PTGS1FPR1LMNASMN1; SMN2
SCHEMBL8550834 0.80 PTGS2 (0.66) PTGS2PTGS1FPR1LMNASMN1; SMN2
SCHEMBL8552523 0.80 PTGS2 (0.66) PTGS2PTGS1FPR1LMNASMN1; 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