SCHEMBL5877789

SCHEMBL5877789

O=Cc1cccc(S(=O)(=O)CCCl)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
ALDH1A1 P00352 4/20 0.40
UNG P13051 1/20 0.37
NAT1 P18440 1/20 0.35
MAOA P21397 7/20 0.35
MAOB P27338 7/20 0.35
CYP2A6 P11509 1/20 0.34
SRC P12931 1/20 0.33
TRIM24 O15164 1/20 0.33
TRIM33 Q9UPN9 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL55285 0.83 CA1 (0.44) CA12CA1CA2CA9ALDH1A1
SCHEMBL11735462 0.80 PSIP1 (0.52) CA12CA1CA2CA9ALDH1A1
SCHEMBL15652362 0.80 CA2 (0.43) CA12CA1CA2CA9ALDH1A1
SCHEMBL8666666 0.78 HSD17B10 (0.41) CA2ALDH1A1CYP2A6
SCHEMBL7380872 0.76 ALDH1A1 (0.48) CA12CA1CA2CA9ALDH1A1
SCHEMBL31604493 0.75 ALDH1A1 (0.50) CA12CA1CA2CA9ALDH1A1
SCHEMBL6853269 0.75 ALDH1A1 (0.50) CA12CA1CA2CA9ALDH1A1
SCHEMBL17699828 0.75 ATM (0.43) MEN1KMT2A
SCHEMBL4392802 0.75 LMNA (0.57) CA12CA1CA2CA9ALDH1A1
SCHEMBL4185645 0.75 KMT2A (0.51) ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0219080-B1 WATER SOLUBLE DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DE) 1990-03-14 EP claimed
US-4818814-A COLORFASTNESS HOECHST AKTIENGESELLSCHAFT (DE) 1989-04-04 US claimed
US-4785099-A FIBER-REACTIVE DYES FOR CELLULOSE HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-15 US claimed
US-7132517-B2 Water-soluble fiber-reactive disazo dyes, method for producing the same and the use thereof DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2006-11-07 US disclosed
US-20050241079-A1 Water-soluble fiber-reactive disazo dyes, method for producing the same and the use thereof DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2005-11-03 US disclosed
EP-1516019-A1 WATER-SOLUBLE FIBRE-REACTIVE DISAZO DYES, METHOD FOR PRODUCING THE SAME AND THE USE THEREOF DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2005-03-23 EP disclosed
WO-2003104335-A1 WATER-SOLUBLE FIBRE-REACTIVE DISAZO DYES, METHOD FOR PRODUCING THE SAME AND THE USE THEREOF DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2003-12-18 WO disclosed
EP-0773264-B1 Process for the preparation of triphenodioxazine dyes amidated on both sides and triphenodioxazine dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-10-10 EP disclosed
US-5944854-A LEUCO DYES DYSTAR TEXTILFARBEN GMBH & CO. (DE) 1999-08-31 US disclosed
US-5696258-A REDUCING TO LEUCO FORM; REOXIDATION DYSTAR TEXTILFARBEN GMBH (DE) 1997-12-09 US disclosed
EP-0773264-A1 Process for the preparation of triphenodioxazine dyes amidated on both sides and triphenodioxazine dyes DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1997-05-14 EP disclosed
EP-0538785-A2 Water-soluble fiber-reactive dyes, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-04-28 EP disclosed
US-5021558-A Color strength, fastness HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-04 US disclosed
WO-1990013604-A1 WATER-SOLUBLE REACTIVE DYES FOR FIBRES, THEIR PREPARATION AND USE HOECHST AKTIENGESELLSCHAFT (DE) 1990-11-15 WO disclosed
EP-0388864-A2 Water-soluble, fibre-reactive dyes, method of their preparation and use HOECHST AKTIENGESELLSCHAFT (DE) 1990-09-26 EP disclosed
US-4818814-A COLORFASTNESS HOECHST AKTIENGESELLSCHAFT (DE) 1989-04-04 US disclosed
US-4818814-A COLORFASTNESS HOECHST AKTIENGESELLSCHAFT (DE) 1989-04-04 US disclosed
US-4785099-A FIBER-REACTIVE DYES FOR CELLULOSE HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-15 US disclosed
EP-0229339-A2 Water soluble triphene dioxazine compounds, their starting compounds containing sulphonyl groups, process for their preparation and use of the triphene dioxazines as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1987-07-22 EP disclosed
US-4534908-A Water-soluble disazo compounds and new bis-(aminophenoxy)-ethane compounds having fiber-reactive groups as the tetrazo components, and use of the disazo compounds as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1985-08-13 US disclosed