SCHEMBL4036997

SCHEMBL4036997

COc1cc(C)c(S(=O)(=O)CNCC=CC(=O)N(C)Cc2ccc(C3=NCCN3)cc2)c(C)c1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 16/20 0.58
NISCH Q9Y2I1 2/20 0.39
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL4036994 1.00 BDKRB1 (0.58) BDKRB1NISCHKDM4E
SCHEMBL4036922 0.92 BDKRB1 (0.53) BDKRB1NISCH
SCHEMBL4036918 0.92 BDKRB1 (0.53) BDKRB1NISCH
SCHEMBL4031815 0.85 BDKRB1 (0.64) BDKRB1NISCH
SCHEMBL4036992 0.85 BDKRB1 (0.68) BDKRB1NISCHKDM4E
SCHEMBL4030385 0.85 BDKRB1 (0.59) BDKRB1NISCH
SCHEMBL4030386 0.85 BDKRB1 (0.59) BDKRB1NISCH
SCHEMBL4029492 0.83 BDKRB1 (0.55) BDKRB1NISCH
SCHEMBL4029495 0.83 BDKRB1 (0.55) BDKRB1NISCH
SCHEMBL4027522 0.83 BDKRB1 (0.57) BDKRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7361687-B2 Arylsulphonamide derivatives and methods of preparing LABORATOIRES FOURNIER SA (FR) 2008-04-22 US claimed
US-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents LABORATOIRES FOURNIER SA (FR) 2006-04-20 US claimed
EP-1521744-B1 ARYLSULPHONAMIDE DERIVATIVES AND USE THEREOF AS B1 BRADYKININ RECEPTOR ANTAGONISTS FOURNIER LAB SA (FR) 2009-04-01 EP disclosed
US-7361687-B2 Arylsulphonamide derivatives and methods of preparing LABORATOIRES FOURNIER SA (FR) 2008-04-22 US disclosed
US-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents LABORATOIRES FOURNIER SA (FR) 2006-04-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents UGT1A1, UGT2B7, UGT1A6 BDKRB1 1217/4885NISCH 2280/4885KDM4E 3264/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.