SCHEMBL4032633

SCHEMBL4032633

CN(CCC(=O)O)S(=O)(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.48
NR1H4 Q96RI1 4/20 0.47
GAA P10253 2/20 0.43
DAGLA Q9Y4D2 2/20 0.43
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
BDKRB1 P46663 1/20 0.41
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
KDM4E B2RXH2 1/20 0.40
AKR1B1 P15121 1/20 0.40

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
SCHEMBL5124229 0.90 GAA (0.48) HTTNR1H4GAADAGLAALDH1A1
SCHEMBL3439979 0.84 MCOLN3 (0.55) HTTGAAALDH1A1L3MBTL1BDKRB1
SCHEMBL4033897 0.82 GSTO1 (0.46) NR1H4DAGLAALDH1A1BDKRB1KDM4E
SCHEMBL4032663 0.82 NR1H4 (0.51) HTTNR1H4GAADAGLALMNA
SCHEMBL493618 0.81 BDKRB1 (0.53) HTTNR1H4DAGLAALDH1A1BDKRB1
SCHEMBL5803141 0.81 VCAM1 (0.39) HTTNR1H4GAADAGLABDKRB1
SCHEMBL6188678 0.81 HTT (0.51) HTTNR1H4GAADAGLA
SCHEMBL4030349 0.80 HTT (0.50) HTTNR1H4GAADAGLALMNA
SCHEMBL6763996 0.79 POLB (0.45) HTTGAADAGLAALDH1A1L3MBTL1
SCHEMBL4030931 0.77 HTT (0.44) HTTNR1H4GAADAGLAALDH1A1

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 HTT 2903/4885NR1H4 15/4885GAA 215/4885

“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.