SCHEMBL8556342

SCHEMBL8556342

Cc1ccc(-n2ncc(C#N)c2NC(=O)NS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 9/20 0.72
PTGS1 P23219 8/20 0.72
FPR1 P21462 1/20 0.49
LMNA P02545 2/20 0.46
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 1/20 0.45
FBP1 P09467 1/20 0.45
KDM4E B2RXH2 1/20 0.45
GFER P55789 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL8550834 0.95 PTGS2 (0.66) PTGS2PTGS1FPR1LMNAALDH1A1
SCHEMBL8553129 0.95 PTGS2 (0.66) PTGS2PTGS1FPR1LMNAALDH1A1
SCHEMBL8552523 0.95 PTGS2 (0.66) PTGS2PTGS1FPR1LMNAALDH1A1
SCHEMBL8554553 0.95 PTGS2 (0.66) PTGS2PTGS1FPR1LMNAGFER
SCHEMBL8551988 0.93 PTGS2 (0.73) PTGS2PTGS1FPR1LMNASMN1; SMN2
SCHEMBL8559075 0.92 PTGS2 (0.63) PTGS2PTGS1FPR1LMNAALDH1A1
SCHEMBL8552699 0.86 PTGS1 (0.55) PTGS2PTGS1FPR1LMNAALDH1A1
SCHEMBL8551424 0.86 PTGS1 (0.65) PTGS2PTGS1FPR1GFER
SCHEMBL8554538 0.86 PTGS1 (0.54) PTGS2PTGS1LMNAALDH1A1SMN1; SMN2
SCHEMBL8557299 0.85 PTGS1 (0.53) PTGS2PTGS1FPR1LMNAALDH1A1

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