SCHEMBL4027744

SCHEMBL4027744

CC(=O)ON=NCc1ccc(CN(C)C(=O)CCCCNCS(=O)(=O)c2ccc(Cl)c(C)c2Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 5/20 0.43
ALDH1A1 P00352 2/20 0.31
HTT P42858 2/20 0.31
RAB9A P51151 1/20 0.31
HDAC3 O15379 1/20 0.30
HDAC4 P56524 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC7 Q8WUI4 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC10 Q969S8 1/20 0.30
HDAC11 Q96DB2 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
HDAC9 Q9UKV0 1/20 0.30
HDAC5 Q9UQL6 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL4027737 0.87 BDKRB1 (0.42) BDKRB1ALDH1A1HTTRAB9AHDAC3
SCHEMBL6186876 0.87 BDKRB1 (0.42) BDKRB1ALDH1A1HTTRAB9AHDAC3
SCHEMBL4027742 0.84 BDKRB1 (0.59) BDKRB1ALDH1A1HTTRAB9A
SCHEMBL4027527 0.83 BDKRB1 (0.46) BDKRB1ALDH1A1HTTRAB9AHDAC3
SCHEMBL4027530 0.82 BDKRB1 (0.45) BDKRB1ALDH1A1HTTRAB9AHDAC3
SCHEMBL4040824 0.82 BDKRB1 (0.48) BDKRB1ALDH1A1HTTRAB9ASMN1; SMN2
SCHEMBL4031286 0.77 BDKRB1 (0.73) BDKRB1
SCHEMBL4032602 0.77 BDKRB1 (0.54) BDKRB1ALDH1A1HTTRAB9A
SCHEMBL4036660 0.75 BDKRB1 (0.74) BDKRB1
SCHEMBL5118845 0.73 BDKRB1 (0.50) 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
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
EP-1521744-A1 ARYLSULPHONAMIDE DERIVATIVES AND USE THEREOF AS B1 BRADYKININ RECEPTOR ANTAGONISTS LABORATOIRES FOURNIER S.A. (FR) 2005-04-13 EP disclosed
WO-2003106428-A1 NOVEL ARYLSULPHONAMIDE DERIVATIVES AND USE THEREOF AS THERAPEUTIC AGENTS LABORATOIRES FOURNIER SA (FR) 2003-12-24 WO 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 1217/4885ALDH1A1 73/4885HTT 2903/4885

“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.