SCHEMBL6937115

SCHEMBL6937115

CN(C)S(=O)(=O)c1ccc(O)c(N)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.63
GAA P10253 3/20 0.63
CA12 O43570 1/20 0.63
CA1 P00915 1/20 0.63
CA2 P00918 1/20 0.63
CA9 Q16790 1/20 0.63
ALDH1A1 P00352 5/20 0.61
HSD17B10 Q99714 2/20 0.61
SERPINE1 P05121 3/20 0.55
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
PKM P14618 2/20 0.54
POLB P06746 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 2/20 0.44
LMNA P02545 1/20 0.44
ALOX15 P16050 1/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
TNF P01375 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
SCHEMBL7933846 0.85 ALDH1A1 (0.58) MAPTGAACA12CA1CA2
SCHEMBL11492952 0.82 SERPINE1 (0.78) MAPTALDH1A1HSD17B10SERPINE1MEN1
SCHEMBL914479 0.82 ALDH1A1 (0.64) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL4900235 0.81 SERPINE1 (0.64) MAPTGAACA12CA1CA2
SCHEMBL26419109 0.80 SERPINE1 (0.55) MAPTGAACA12CA1CA2
SCHEMBL172720 0.79 ESR1 (0.56) MAPTGAAALDH1A1SERPINE1SMN1; SMN2
SCHEMBL6265475 0.79 ALDH1A1 (0.56) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL11649718 0.79 SERPINE1 (0.56) MAPTGAACA12CA1CA2
SCHEMBL20582857 0.79 GAA (0.70) MAPTGAACA12CA1CA2
SCHEMBL634380 0.79 GAA (0.70) MAPTGAACA12CA1CA2

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8382857-B2 Method for the reactive coloration of leather BASF SE (DE) 2013-02-26 US disclosed
US-8382857-B2 Method for the reactive coloration of leather BASF SE (DE) 2013-02-26 US disclosed
US-8372161-B2 Method for the reactive coloring of leather BASF SE (DE) 2013-02-12 US disclosed
US-8372161-B2 Method for the reactive coloring of leather BASF SE (DE) 2013-02-12 US disclosed
US-20110213029-A1 3,4-Di-Substituted Cyclobutene-1,2-Diones as CXC-Chemokine Receptor Ligands SCHERING CORPORATION (US) 2011-09-01 US disclosed
US-20110213029-A1 3,4-Di-Substituted Cyclobutene-1,2-Diones as CXC-Chemokine Receptor Ligands SCHERING CORPORATION (US) 2011-09-01 US disclosed
US-7964646-B2 3,4-DI-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands SCHERING CORPORATION (US) 2011-06-21 US disclosed
US-7964646-B2 3,4-DI-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands SCHERING CORPORATION (US) 2011-06-21 US disclosed
EP-1818325-B1 3,4-DI-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands SCHERING CORP (US) 2010-02-24 EP disclosed
US-20090306079-A1 3,4-DI-SUBSTITUTED CYCLOBUTENE-1,2-DIONES AS CXC-CHEMOKINE RECEPTOR LIGANDS SCHERING CORPORATION 2009-12-10 US disclosed
US-4906736-A Copper complex formazan compounds containing a phenylaminotriazinylamino group with a fiber-reactive group of the vinylsulfone series and an alkyl amino substituent in the phenyl moiety suitable as fiber-reactive dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1990-03-06 US disclosed
EP-0338310-A1 Reactive dyes BAYER AG (DE) 1989-10-25 EP disclosed
EP-0280139-A2 Complex copper formazane compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1988-08-31 EP disclosed
EP-0099721-B1 REACTIVE METAL FORMAZAN BLUE DYE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-10-29 EP disclosed
EP-0054230-B1 MONOAZO DYESTUFFS AND USE AS IMAGE-FORMING DYESTUFFS IN COLOUR-PHOTOGRAPHIC REGISTRATION MATERIALS Agfa-Gevaert AG (DE) 1985-03-20 EP disclosed
EP-0099721-A1 Reactive metal formazan blue dye SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-02-01 EP disclosed
US-4396710-A Photographic recording material with metal complexable, heterocyclic azo dye AFGA-GEVAERT AKTIENGESELLSCHAFT (DE) 1983-08-02 US disclosed
EP-0054230-A2 Monoazo dyestuffs and use as image-forming dyestuffs in colour-photographic registration materials Agfa-Gevaert AG (DE) 1982-06-23 EP disclosed
US-4141890-A FIBER-REACTIVE CIBA-GEIGY CORPORATION (US) 1979-02-27 US disclosed
US-3985763-A DYESTUFFS BAYER AKTIENGESELLSCHAFT (DT) 1976-10-12 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 (2 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-20110213029-A1 3,4-Di-Substituted Cyclobutene-1,2-Diones as CXC-Chemokine Receptor Ligands CCR1, ACKR3, CXCR1 MAPT 4618/4885GAA 4850/4885CA12 1004/4885
US-20090306079-A1 3,4-DI-SUBSTITUTED CYCLOBUTENE-1,2-DIONES AS CXC-CHEMOKINE RECEPTOR LIGANDS CCR1, ACKR3, CXCR1 MAPT 4618/4885GAA 4850/4885CA12 1004/4885

“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.