SCHEMBL6885235

SCHEMBL6885235

Nc1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1Br

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.53
CA1 P00915 8/20 0.53
CA9 Q16790 7/20 0.53
CA12 O43570 5/20 0.53
CA4 P22748 4/20 0.53
CA6 P23280 4/20 0.53
CA5A P35218 4/20 0.53
CA7 P43166 4/20 0.53
CA14 Q9ULX7 4/20 0.53
CA5B Q9Y2D0 4/20 0.53
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
THRB P10828 1/20 0.34
ALDH1A1 P00352 4/20 0.33
CA3 P07451 1/20 0.33

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
SCHEMBL8707661 0.88 CA2 (0.40) CA2CA1CA9CA12CA4
SCHEMBL8018573 0.85 ALDH1A1 (0.44) CA2CA1CA9CA12CA4
SCHEMBL6029167 0.83 HSD17B10 (0.45) CA2CA1CA9CA12CA4
SCHEMBL9558736 0.83 CA2 (0.41) CA2KDM4EMEN1GAAMAPT
SCHEMBL10692522 0.83 CA1 (0.47) CA2CA1CA9CA12CA4
SCHEMBL8951838 0.83 CA2 (0.48) CA2CA1CA9CA12CA4
SCHEMBL872920 0.82 CTDSP1 (0.40) CA2KDM4EMEN1GAAMAPT
SCHEMBL7628391 0.82 CA2 (0.51) CA2CA1CA9CA12CA4
SCHEMBL9149714 0.81 CA2 (0.59) CA2CA1CA9CA12CA4
SCHEMBL7621250 0.81 GAA (0.36) CA2KDM4EMEN1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1030984-C Method for preparing amino aryl-beta-sulfatoethyl sulfone HOECHST AG (DE) 1996-02-14 CN claimed
US-5463100-A Spraying a mixture of an aminoaryl beta-hydroxyethylsulfone and sulfuric acid into a hot gas stream; drying, esterification and any hydrolysis take place simultaneously; granules HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-31 US claimed
EP-0390826-B1 PROCESS FOR PRODUCING AMINOARYL-BETA-SULPHATOETHYLSULPHONE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1992-11-19 EP claimed
CN-1033867-A CIGARETTE LIGHTER TDK CORP (JP) 1989-07-12 CN claimed
US-6809187-B2 FIBER REACTIVE COPPER, COBALT OR CHROMIUM CHELATES; LIGHT-FASTNESS; EFFICIENT UNFIXED MATERIAL WASHOFF OYSTAR TEXTIL FARBEN GMBH & CO. (DE) 2004-10-26 US disclosed
US-20040054154-A1 Metal complex dyes based bucherered naphthols DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2004-03-18 US disclosed
US-6060591-A FOR DYEING A MATERIAL CONTAINING HYDROXY OR CARBOXAMIDE GROUPS OR BOTH DY STAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND K.G. (DE) 2000-05-09 US disclosed
CN-1235992-A Water-soluble fiber-reactive dyes, processes for their preparation and their use HOECHST AG (DE) 1999-11-24 CN disclosed
US-5834601-A DYEING CELLULOSE, WOOL, POLYAMIDE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-11-10 US disclosed
US-5514782-A Phenyl-azo-aminophenyl compounds substituted by an aminosubstituted fluoro-triazinylamino group and a fibre-reactive group of the vinylsulfone series HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-07 US disclosed
CN-1030984-C Method for preparing amino aryl-beta-sulfatoethyl sulfone HOECHST AG (DE) 1996-02-14 CN disclosed
US-5463031-A Printing, dyeing cellulose and organonitrogen compounds BAYER AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
EP-0201868-A1 Water soluble disazo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1986-11-20 EP disclosed
US-4492654-A BLUE OR BLACK DISAZO DYES HOECHST AKTIENGESELLSCHAFT (DE) 1985-01-08 US disclosed
US-4430259-A Water-soluble disazo compounds suitable as fiber-reactive dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1984-02-07 US disclosed
US-4394310-A DIAZOTIZATION, CYCLIZATION HOECHST AKTIENGESELLSCHAFT (DE) 1983-07-19 US disclosed
US-RE30650-E Dispersing and stabilizing agents for dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1981-06-16 US disclosed
US-4252529-A AMINOPHENOL OR AMINONAPHTHOL COMPOUND WITH SUBSTITUTED FIBER-REACTIVE RADICAL HOECHST AKTIENGESELLSCHAFT (DE) 1981-02-24 US disclosed
US-4035350-A Process for the preparation of water-soluble azo dyestuffs by reacting an aromatic amine and a coupling component with alkali metal nitrite or alkyl nitrite in the absence of acid HOECHST AKTIENGESELLSCHAFT (DT) 1977-07-12 US disclosed
US-3993439-A SULFONATED PHENOLIC COMPONENT-FORMALDEHYDE CO-CONDENSATION PRODUCT HOECHST AKTIENGESELLSCHAFT (DT) 1976-11-23 US disclosed