SCHEMBL7046102

SCHEMBL7046102

COc1[c]cc(S(=O)(=O)O)c(OC)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
GSK3B P49841 1/20 0.36
PKM P14618 2/20 0.36
TRPV4 Q9HBA0 1/20 0.35
MPL P40238 1/20 0.34
TSHR P16473 3/20 0.33
GAA P10253 3/20 0.33
NPBWR1 P48145 1/20 0.33
KDM4E B2RXH2 3/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GLA P06280 1/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL1374507 0.86 ALDH1A1 (0.39) ALDH1A1MAPTLMNAKMT2AGSK3B
SCHEMBL9871982 0.84 SMN1; SMN2 (0.44) ALDH1A1LMNAPKMTRPV4TSHR
SCHEMBL9166696 0.83 TUBB1 (0.38) ALDH1A1MAPTKMT2AGAAKDM4E
SCHEMBL6934666 0.82 ALDH1A1 (0.39) ALDH1A1MAPTLMNAKMT2AGSK3B
SCHEMBL9164749 0.79 LMNA (0.36) ALDH1A1MAPTLMNAKMT2AMPL
SCHEMBL1377271 0.79 BRD4 (0.33) ALDH1A1MAPTLMNAKMT2APOLB
SCHEMBL1888725 0.76 ALDH1A1 (0.51) ALDH1A1MAPTLMNAKMT2AGSK3B
SCHEMBL8426114 0.76 VCAM1 (0.40) ALDH1A1MAPTKMT2ATSHRGAA
SCHEMBL9774295 0.74 ALDH1A1 (0.50) ALDH1A1MAPTLMNAKMT2AGSK3B
SCHEMBL592705 0.72 CYP3A4 (0.39) ALDH1A1MAPTTSHRKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0765965-B1 Process for deying synthetic fibrous polyamid materials DYSTAR TEXTILFARBEN GMBH & CO (DE) 2003-06-04 EP disclosed
WO-2003006560-A2 AQUEOUS INK FORMULATIONS FOR INKJET PRINTING DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2003-01-23 WO disclosed
EP-1127923-A2 Water-soluble fibre-reactive dyestuffs, process for their preparation and their use DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2001-08-29 EP disclosed
EP-0971986-B1 REACTIVE DYES CONTAINING A PERMANENT QUATERNARY AMMONIUM GROUP DYSTAR L P (US) 2001-06-27 EP disclosed
EP-0719841-B1 Mixture of water soluble reactive azo dyes, process to manufacture it and its use DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-03-14 EP disclosed
EP-0838504-B1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof DYSTAR TEXTILFARBEN GMBH & CO (DE) 2000-06-07 EP 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
EP-0971986-A1 REACTIVE DYES CONTAINING A PERMANENT QUATERNARY AMMONIUM GROUP DyStar L.P. (US) 2000-01-19 EP disclosed
US-5980590-A HIGH COLOR YIELD; FOR DYEING OR PRINTING OF CELLULOSIC FIBERS, WOOL, AND POLYAMIDE FIBERS DYSTAR TEXILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1999-11-09 US disclosed
EP-0765918-B1 Reactive dye preparations DYSTAR TEXTILFARBEN GMBH & CO (DE) 1999-07-28 EP disclosed
US-5399674-A Dyestuffs containing pyrimidine-carboxylic acid amide radical having fiber-reactive group, processes for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1995-03-21 US disclosed
EP-0629667-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-21 EP disclosed
EP-0624630-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1994-11-17 EP disclosed
EP-0603595-A1 Fibre reactive dyes, method for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-29 EP disclosed
US-5280110-A Fiber-reactive dye HOECHST AKTIENGESELLSCHAFT (DE) 1994-01-18 US disclosed
EP-0548792-A2 Water-soluble reactive dyes, their manufacture and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-30 EP disclosed
US-4806640-A Triphendioxazine reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1989-02-21 US disclosed
EP-0205080-B1 TRIPHENODIOXAZINE-DISULFIMIDE REACTIVE DYES BAYER AG (DE) 1989-01-18 EP disclosed
EP-0204245-B1 REACTIVE DYES BAYER AG (DE) 1988-12-21 EP disclosed
EP-0204245-A2 Reactive dyes BAYER AG (DE) 1986-12-10 EP disclosed