SCHEMBL7588620

SCHEMBL7588620

Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(N=Nc3ccc4c(S(=O)(=O)O)cccc4c3S(=O)(=O)O)c(O)c12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHLPP2 Q6ZVD8 3/20 0.64
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
HTT P42858 1/20 0.63
ENPP2 Q13822 4/20 0.60
CYP1A2 P05177 4/20 0.58
MAPK1 P28482 2/20 0.57
CYP2C9 P11712 1/20 0.57
DNASE1L3 Q13609 1/20 0.57
PRMT1 Q99873 1/20 0.52
THRB P10828 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
USP2 O75604 1/20 0.47
PTPN1 P18031 1/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 2/20 0.47
HIF1A Q16665 1/20 0.47
FUT8 Q9BYC5 1/20 0.44
ATIC P31939 1/20 0.42

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
SCHEMBL10619899 0.99 PHLPP2 (0.63) PHLPP2MEN1KMT2AHTTENPP2
SCHEMBL10619920 0.90 USP2 (0.61) PHLPP2MEN1KMT2AHTTENPP2
SCHEMBL10619876 0.90 USP2 (0.61) PHLPP2MEN1KMT2AHTTENPP2
SCHEMBL6028562 0.89 PHLPP2 (0.65) PHLPP2MEN1KMT2AHTTENPP2
SCHEMBL6028561 0.89 PHLPP2 (0.65) PHLPP2MEN1KMT2AHTTENPP2
SCHEMBL8779905 0.89 ENPP2 (0.57) PHLPP2MEN1KMT2AHTTENPP2
SCHEMBL7588604 0.88 CYP1A2 (0.57) PHLPP2MEN1KMT2AHTTENPP2
SCHEMBL13763514 0.88 CYP1A2 (0.57) PHLPP2MEN1KMT2AHTTENPP2
SCHEMBL7588609 0.88 CYP1A2 (0.57) PHLPP2MEN1KMT2AHTTENPP2
SCHEMBL14493388 0.87 ENPP2 (0.65) PHLPP2MEN1KMT2AHTTENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1795562-A2 Fiber reactive dyestuffs Everlight USA, Inc. (US) 2007-06-13 EP disclosed
EP-0669381-B1 Dye, ink containing the same, and ink-jet recording method and instrument using the ink CANON KK (JP) 2002-09-11 EP disclosed
US-5733363-A WATER FASTNESS; SOLUTION SOLUBILITY CANON KABUSHIKI KAISHA (JP) 1998-03-31 US disclosed
EP-0492128-B1 Triazine compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL CO (JP) 1997-06-04 EP disclosed
EP-0669381-A2 Dye, ink containing the same, and ink-jet recording method and instrument using the ink CANON KABUSHIKI KAISHA (JP) 1995-08-30 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-0603595-A1 Fibre reactive dyes, method for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-29 EP disclosed
US-5235046-A Colorfast, washfast SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-10 US disclosed
US-5183501-A A water-soluble azo, phthalocyanine, anthraquinone, dioxazine or formazan dye having one or more-SO2-CH2-CH2-SO3H groups, a solvent and water; heat and water resistance; colorfastness SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-02-02 US disclosed
US-5128455-A WATER-SOLUBLE FIBER-REACTIVE DYES, CONTAINING AN AMINO-SUBSTITUTED 5-TRIAZINE RING WITH A FIBER-REACTIVE GROUP OF THE VINYLSULFONE SERIES HOECHST AKTIENGESELLSCHAFT (DE) 1992-07-07 US disclosed
EP-0492128-A1 Triazine compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-07-01 EP disclosed
EP-0481449-A2 Ink compositions for ink jet recording SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-04-22 EP disclosed
EP-0374911-A1 Water-soluble, fibre-reactive dyes, methods for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1990-06-27 EP disclosed
EP-0167219-B1 FIBER-REACTIVE COMPOUND HAVING BOTH PYRIDINIOTRIAZINYL AND VINYLSULFONE TYPE GROUPS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-09-28 EP disclosed
US-4680384-A PYRIMIDINE DYES CIBA-GEIGY CORPORATION (US) 1987-07-14 US disclosed
US-4626589-A Organic dye compound having both pyridiniotriazinyl and vinylsulfone type fiber-reactive groups SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-12-02 US disclosed
EP-0167219-A1 Fiber-reactive compound having both pyridiniotriazinyl and vinylsulfone type groups SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-01-08 EP disclosed
US-4325869-A CONTAINING A PYRIMIDINE RING AND ONE OR MORE AZO GROUPS CIBA-GEIGY CORPORATION (US) 1982-04-20 US disclosed
US-4263206-A Reactive dyestuffs containing chlorine or fluorine substituents and one or more 1,3-dicyanobenzene radicals linked to the dyestuff at the 2-, 4- or 6-position IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-04-21 US disclosed
US-4213899-A FOR CELLULOSE IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-07-22 US disclosed