SCHEMBL4409480

SCHEMBL4409480

Nc1cc(S(=O)(=O)O)[c]cc1S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.37
ALDH1A1 P00352 9/20 0.34
HSD17B10 Q99714 5/20 0.34
KDM4E B2RXH2 3/20 0.34
TDP1 Q9NUW8 3/20 0.34
CASP6 P55212 2/20 0.34
CASP1 P29466 2/20 0.34
CASP7 P55210 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NQO1 P15559 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
AURKA O14965 1/20 0.33
AURKB Q96GD4 1/20 0.33
NT5E P21589 2/20 0.32
TSHR P16473 3/20 0.31
GAA P10253 3/20 0.31
MAPT P10636 3/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31

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
SCHEMBL10646743 0.86 TTR (0.36) TTRALDH1A1HSD17B10KDM4ETDP1
SCHEMBL2214202 0.83 TTR (0.37) TTRALDH1A1HSD17B10KDM4ETDP1
SCHEMBL6633299 0.83 LMNA (0.31) HSD17B10HPGD
SCHEMBL28754366 0.80 CA12 (0.37) TTRALDH1A1HSD17B10TDP1CASP6
SCHEMBL5049711 0.78 BRD4 (0.39) SUMO2SUMO1SENP7SENP2BRD4
SCHEMBL27460264 0.77
SCHEMBL6142173 0.75 HSD17B10 (0.40) ALDH1A1HSD17B10TDP1CASP6CASP1
SCHEMBL1412987 0.74 TTR (0.46) TTRALDH1A1HSD17B10KDM4ETDP1
SCHEMBL10508320 0.73 BRD4 (0.36) HSD17B10BRD4TP53CREBBPRECQL
SCHEMBL10883325 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0712841-B1 Process for the preparation of 3(N-aryl-amino)-propyl-2'-sulfatoethylsulfonyl compounds DYSTAR TEXTILFARBEN GMBH & CO (DE) 1999-01-13 EP claimed
US-5777111-A DERIVATIVES OF ARYL SUBSTITUTED 1,3-OXAZINES HOECHST AKTIENGESELLSCHAFT (DE) 1998-07-07 US claimed
EP-0712841-A1 Process for the preparation of 3(N-aryl-amino)-propyl-2'-sulfatoethylsulfonyl compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-22 EP claimed
US-8834619-B2 Ink composition, ink for inkjet recording and inkjet recording method FUJIFILM CORPORATION (JP) 2014-09-16 US disclosed
EP-2687565-A1 INK COMPOSITION, INKJET PRINTING INK, AND INKJET PRINTING METHOD FUJIFILM Corporation (JP) 2014-01-22 EP disclosed
US-20140013997-A1 INK COMPOSITION, INK FOR INKJET RECORDING AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2014-01-16 US disclosed
CN-103429674-A Ink composition, ink for inkjet recording, and inkjet recording method FUJI PHOTO FILM CO LTD 2013-12-04 CN disclosed
EP-1697467-B1 TRISAZO-DYESTUFFS FUJIFILM IMAGING COLORANTS LTD (GB) 2012-12-26 EP disclosed
US-7638609-B2 Trisazo-dyestuffs FUJIFILM IMAGING COLORANTS LIMITED (GB) 2009-12-29 US disclosed
US-20070062409-A1 Trisazo-dyestuffs FUJIFILM IMAGING COLORANTS LIMITED (GB) 2007-03-22 US disclosed
EP-1697467-A1 TRISAZO-DYESTUFFS FUJIFILM Imaging Colorants Limited (GB) 2006-09-06 EP disclosed
US-5672738-A REACTING AN AROMATIC SUBSTITUTED CYCLIC CARBAMATE WITH 2-MERCAPTETHANOL IN PRESENCE OF A BASIC CATALYST HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-30 US disclosed
EP-0712841-A1 Process for the preparation of 3(N-aryl-amino)-propyl-2'-sulfatoethylsulfonyl compounds HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-22 EP disclosed
US-4730038-A Water-soluble disazo compounds of 1-amino-8-naphthal-3,6- or 4,6-disulfonic acid as bivalent coupling component, containing fiber-reactive groups suitable as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1988-03-08 US disclosed
US-4622390-A DYEING FIBERS OF CELLULOSE, POLYAMIDES, POLYURETHANES HOECHST AKTIENGESELLSCHAFT (DE) 1986-11-11 US disclosed
EP-0065732-B1 WATER SOLUBLE DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1985-08-21 EP disclosed
EP-0048355-B1 WATER-SOLUBLE DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1984-07-25 EP disclosed
EP-0065732-A1 Water soluble disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1982-12-01 EP disclosed
EP-0048355-A1 Water-soluble disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1982-03-31 EP disclosed
EP-0001629-B1 WATER-SOLUBLE, FIBRE-REACTIVE, GREEN AZO-PHTHALOCYANINE DYESTUFFS, THEIR PREPARATION AND THEIR USE CASSELLA Aktiengesellschaft (DE) 1981-08-12 EP disclosed