SCHEMBL1122555

SCHEMBL1122555

CN(c1ccccc1)S(=O)(=O)C=Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.46
HDAC1 Q13547 2/20 0.45
HDAC8 Q9BY41 2/20 0.45
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
PPARG P37231 5/20 0.44
LMNA P02545 3/20 0.44
NFE2L2 Q16236 2/20 0.44
ALDH1A1 P00352 3/20 0.44
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
HTT P42858 2/20 0.41
TRPM8 Q7Z2W7 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
SCHEMBL1122564 0.86 NFE2L2 (0.56) RELAPPARGLMNANFE2L2ALDH1A1
SCHEMBL1122565 0.86 NFE2L2 (0.56) RELAPPARGLMNANFE2L2ALDH1A1
SCHEMBL18864926 0.82 ALDH1A1 (0.51) RELAPPARGLMNANFE2L2ALDH1A1
SCHEMBL18864927 0.82 ALDH1A1 (0.51) RELAPPARGLMNANFE2L2ALDH1A1
SCHEMBL5051066 0.77 ALDH1A1 (0.47) PPARGLMNANFE2L2ALDH1A1HTT
SCHEMBL21593710 0.76 HTT (0.50) PPARGLMNANFE2L2ALDH1A1HTT
SCHEMBL7157659 0.75 CA12 (0.47) LMNACA12CA9HTTMAPT
SCHEMBL21593706 0.74 NPC1 (0.46) PPARGLMNANFE2L2ALDH1A1HTT
SCHEMBL18865304 0.74 ALDH1A1 (0.46) PPARGLMNANFE2L2ALDH1A1TRPM8
SCHEMBL18865305 0.74 ALDH1A1 (0.46) PPARGLMNANFE2L2ALDH1A1TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1379508-B9 N-(ARYL)-2-ARYLETHENESULFONAMIDES AND THERAPEUTIC USES THEREOF UNIV TEMPLE (US) 2011-02-09 EP disclosed
EP-1379508-B1 N-(ARYL)-2-ARYLETHENESULFONAMIDES AND THERAPEUTIC USES THEREOF UNIV TEMPLE (US) 2010-09-01 EP disclosed
EP-1379508-A4 N-(ARYL)-2-ARYLETHENESULFONAMIDES AND THERAPEUTIC USES THEREOF UNIV TEMPLE (US) 2005-12-28 EP disclosed
EP-1379508-A2 N-(ARYL)-2-ARYLETHENESULFONAMIDES AND THERAPEUTIC USES THEREOF Temple University of the Commonwealth System of Higher Education (US) 2004-01-14 EP disclosed
US-6646009-B2 Use against proliferative disorders including cancer, and as a radioprotective compound for normal cells from ionizing radiation Temple University — Of Commonwealth System of Higher Education 2003-11-11 US disclosed
US-20020165412-A1 N-(aryl)-2-arylethenesulfonamides and therapeutic uses thereof ONCONOVA THERAPEUTICS, INC. 2002-11-07 US disclosed
WO-2002067865-A2 N-(ARYL)-2-ARYLETHENESULFONAMIDES AND THERAPEUTIC USES THEREOF TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2002-09-06 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-20020165412-A1 N-(aryl)-2-arylethenesulfonamides and therapeutic uses thereof HCCS, NAT1, ARSA RELA 1762/4885HDAC1 185/4885HDAC8 371/4885

“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.