SCHEMBL4649751

SCHEMBL4649751

Nc1cc(S(=O)(=O)O)cc(N)c1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 3/20 0.62
GAA P10253 3/20 0.62
NSD2 O96028 2/20 0.62
PLCG1 P19174 1/20 0.62
DNMT1 P26358 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
ALDH1A1 P00352 5/20 0.61
HSD17B10 Q99714 4/20 0.61
NT5E P21589 3/20 0.61
ING2 Q9H160 1/20 0.54
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
TSHR P16473 3/20 0.48
MAPT P10636 2/20 0.46
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA9 Q16790 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
DUSP3 P51452 1/20 0.46

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
SCHEMBL5830318 0.86 CASP6 (0.55) CASP6GAANSD2PLCG1DNMT1
SCHEMBL6935562 0.84 CASP6 (0.53) CASP6GAANSD2PLCG1DNMT1
SCHEMBL29163901 0.84 CASP6 (0.53) CASP6GAANSD2PLCG1DNMT1
SCHEMBL9336949 0.84 ALDH1A1 (0.54) CASP6GAANSD2PLCG1DNMT1
SCHEMBL21589346 0.84 ALDH1A1 (0.56) CASP6GAANSD2PLCG1DNMT1
SCHEMBL18268213 0.82 ALDH1A1 (0.54) CASP6GAANSD2PLCG1DNMT1
SCHEMBL5711925 0.82 ALDH1A1 (0.68) CASP6GAANSD2PLCG1DNMT1
SCHEMBL13214341 0.81 CASP6 (0.50) CASP6GAANSD2PLCG1DNMT1
SCHEMBL7827859 0.81 HSD17B10 (0.56) CASP6GAANSD2PLCG1DNMT1
SCHEMBL9070253 0.80 ALDH1A1 (0.52) CASP6GAANSD2PLCG1DNMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106590026-B A kind of reactive blue dye and its preparation and application 泰兴锦云染料有限公司 2018-06-12 CN claimed
CN-106590026-B A kind of reactive blue dye and its preparation and application 泰兴锦云染料有限公司 2018-06-12 CN disclosed
US-9952173-B2 Lead ion sensors, methods of making and uses thereof TONGJI UNIVERSITY (CN) 2018-04-24 US disclosed
EP-3102637-B1 METHOD FOR PURIFICATION OF ANTIBODIES, ANTIBODY FRAGMENTS OR ENGINEERED VARIANTS THEREOF USING SPECIFIC ANTHRAQUINONE DYE-LIGAND STRUCTURES BASF SE (DE) 2018-04-11 EP disclosed
EP-2457955-B1 Trisazo dyes for paper dyeing KEMIRA OYJ (FI) 2017-08-09 EP disclosed
US-20160347789-A1 Method for purification of antibodies, antibody fragments or engineered variants thereof using specific anthraquinone dye-ligand structures BASF SE (DE) 2016-12-01 US disclosed
US-20160347789-A1 Method for purification of antibodies, antibody fragments or engineered variants thereof using specific anthraquinone dye-ligand structures BASF SE (DE) 2016-12-01 US disclosed
US-20160231271-A1 LEAD ION SENSORS, METHODS OF MAKING AND USES THEREOF TONGJI UNIVERSITY (CN) 2016-08-11 US disclosed
US-9023118-B2 Azo dyes KEMIRA OYJ (FI) 2015-05-05 US disclosed
WO-2015042971-A1 LEAD ION SENSORS, METHODS OF MAKING AND USES THEREOF TONGJI UNIVERSITY (CN) 2015-04-02 WO disclosed
US-4719053-A FOR DYES HOECHST AKTIENGESELLSCHAFT (DE) 1988-01-12 US disclosed
US-4677199-A Reactive dyes containing substituted 4-fluoropyridaz-6-one radicals BASF AKTIENGESELLSCHAFT (DE) 1987-06-30 US disclosed
EP-0119441-B1 REACTIVE DYES WITH SUBSTITUTED 4-FLUOROPYRIDAZ-6-ONE GROUPS BASF Aktiengesellschaft (DE) 1987-02-25 EP disclosed
EP-0093369-B1 REACTIVE DYES BAYER AG (DE) 1986-07-23 EP disclosed
EP-0045488-B1 WATER-SOLUBLE FIBRE-REACTIVE COMPOUNDS AND THEIR USE IN FINISHING TEXTILES, AS WELL AS THE BETA-CHLOROETHYL-SULFONYL-METHYL-BENZOIC-ACID HALOGENIDES, AND THEIR USE AS A FIBRE-REACTIVE ANCHOR HOECHST AKTIENGESELLSCHAFT (DE) 1985-06-19 EP disclosed
EP-0133270-A1 Reactive dyes BASF Aktiengesellschaft (DE) 1985-02-20 EP disclosed
EP-0119441-A2 Reactive dyes with substituted 4-fluoropyridaz-6-one groups BASF Aktiengesellschaft (DE) 1984-09-26 EP disclosed
US-4473498-A Water-soluble, fiber-reactive organic dyestuffs containing a β-chloro-ethylsulfonyl-methyl-benzoic acid amide group HOECHST AKTIENGESELLSCHAFT (DE) 1984-09-25 US disclosed
EP-0093369-A2 Reactive dyes BAYER AG (DE) 1983-11-09 EP disclosed
EP-0012969-B1 WATER-SOLUBLE FIBRE-REACTIVE COMPOUNDS AND THEIR USE IN FIBRE FINISHING,ESPECIALLY AS DYESTUFFS,AND DIHALOGENO-PYRIDAZONYL-CARBOXYLIC AND SULFONIC ACID HALIDES AND THEIR USE AS FIBRE-REACTIVE ANCHORS,AS WELL AS PROCESS FOR THE PREPARATION OF THESE COMPOUND HOECHST AKTIENGESELLSCHAFT (DE) 1983-06-08 EP 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-20160347789-A1 Method for purification of antibodies, antibody fragments or engineered variants thereof using specific anthraquinone dye-ligand structures ANTXR2, FCGR3B, IGLV6-57 CASP6 4380/4885GAA 730/4885NSD2 3814/4885

“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.