SCHEMBL4556704

SCHEMBL4556704

C=CCOC(=O)S(=O)(=O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.38
TSHR P16473 2/20 0.36
MAPT P10636 2/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
ABCC4 O15439 1/20 0.30
SNCA P37840 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
APP P05067 1/20 0.30

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
SCHEMBL434329 0.77 TSHR (0.42) CYP3A4TSHRMAPTCACNA1BAPBA1
SCHEMBL5571781 0.76 MAPT (0.41) CYP3A4TSHRMAPTCACNA1BAPBA1
SCHEMBL9635406 0.76 CYP3A4 (0.39) CYP3A4TSHRMAPTCACNA1BAPBA1
SCHEMBL3631121 0.74 CYP3A4 (0.38) CYP3A4TSHRMAPTCACNA1BAPBA1
SCHEMBL11274685 0.73 CYP3A4 (0.41) CYP3A4TSHRMAPTCACNA1BAPBA1
SCHEMBL8085604 0.72 TSHR (0.39) CYP3A4TSHRMAPTCACNA1BAPBA1
SCHEMBL9929 0.71
SCHEMBL744340 0.69
Methane SCHEMBL11128169 0.69
Bicarbonate SCHEMBL9658182 0.69 CYP3A4 (0.45) CYP3A4TSHRMAPTCACNA1BAPBA1

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2665856-B1 FORMULATIONS OF FLUORESCENT WHITENING AGENTS IN DISPERSED FORM HUNTSMAN ADVANCED MAT (SWITZERLAND) GMBH (CH) 2017-03-01 EP disclosed
US-8679199-B2 Formulations of fluorescent whitening agents in dispersed form HUNSTMAN INTERNATIONAL LLC (US) 2014-03-25 US disclosed
EP-2665856-A1 FORMULATIONS OF FLUORESCENT WHITENING AGENTS IN DISPERSED FORM Huntsman Advanced Materials (Switzerland) GmbH (CH) 2013-11-27 EP disclosed
US-20130283547-A1 Formulations of Fluorescent Whitening Agents in Dispersed Form HUNTSMAN INTERNATIONAL LLC (US) 2013-10-31 US disclosed
WO-2012098015-A1 FORMULATIONS OF FLUORESCENT WHITENING AGENTS IN DISPERSED FORM HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2012-07-26 WO disclosed
US-7497971-B2 Mixtures of fluorescent whitening agents CIBA SPECIALTY CHEMICALS CORPORATION (US) 2009-03-03 US disclosed
EP-1570122-B1 MIXTURES OF FLUORESCENT WHITENING AGENTS CIBA HOLDING INC (CH) 2008-11-05 EP disclosed
EP-1224353-B1 MIXTURES OF FLUORESCENT WHITENING AGENTS CIBA SC HOLDING AG (CH) 2008-01-09 EP disclosed
EP-1210476-B1 MIXTURES OF FLUORESCENT WHITENING AGENTS CIBA SC HOLDING AG (CH) 2006-06-14 EP disclosed
US-20060048309-A1 Mixtures of fluorescent whitening agents CIBA SPECIALTY CHEMICALS CORP. 2006-03-09 US disclosed
EP-1570122-A1 MIXTURES OF FLUORESCENT WHITENING AGENTS Ciba SC Holding AG (CH) 2005-09-07 EP disclosed
US-6783698-B1 ISOMERS OF CYANO-SUBSTITUTED 1,4-BIS-STYRYLBENZENES FOR WHITENING POLYESTER FIBERS CIBA SPECIALTY CHEMICALS CORPORATION 2004-08-31 US disclosed
WO-2004053221-A1 MIXTURES OF FLUORESCENT WHITENING AGENTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-06-24 WO disclosed
US-6719922-B1 ISOMERS OF CYANO-SUBSTITUTED 1,4-BIS-STYRYLBENZENES; SYNTHETIC POLYESTER FIBERS CIBA SPECIALTY CHEMICALS CORPORATION 2004-04-13 US disclosed
EP-1224353-A1 MIXTURES OF FLUORESCENT WHITENING AGENTS Ciba SC Holding AG (CH) 2002-07-24 EP disclosed
EP-1210476-A1 MIXTURES OF FLUORESCENT WHITENING AGENTS Ciba SC Holding AG (CH) 2002-06-05 EP disclosed
WO-2001031111-A1 MIXTURES OF FLUORESCENT WHITENING AGENTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-05-03 WO disclosed
WO-2001018301-A1 MIXTURES OF FLUORESCENT WHITENING AGENTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-03-15 WO disclosed
WO-2001010810-A1 A PROCESS FOR THE PREPARATION OF DIVINYL STILBENE COMPOUNDS CIBA SPECIALTY CHEMICALS HOLDING, INC. (CH) 2001-02-15 WO disclosed