SCHEMBL8779901

SCHEMBL8779901

CNCC(=O)Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(N=Nc3ccccc3S(=O)(=O)O)c(O)c12

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.59
▸ CYP1A2 P05177 3/20 0.53
▸ ENPP2 Q13822 7/20 0.53
▸ MAPK1 P28482 2/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ DNASE1L3 Q13609 1/20 0.52
▸ PRMT1 Q99873 1/20 0.49
▸ MEN1 O00255 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ PHLPP2 Q6ZVD8 2/20 0.44
▸ APEX1 P27695 1/20 0.42
▸ CD40 P25942 1/20 0.42
▸ CD40LG P29965 1/20 0.42
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HIF1A Q16665 1/20 0.41

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
SCHEMBL11306748 0.91 PRMT1 (0.54) FUT8CYP1A2ENPP2MAPK1CYP2C9
SCHEMBL8779867 0.91 ENPP2 (0.55) FUT8CYP1A2ENPP2MAPK1CYP2C9
SCHEMBL8779959 0.90 ENPP2 (0.63) FUT8CYP1A2ENPP2MAPK1CYP2C9
SCHEMBL8779895 0.87 CYP1A2 (0.54) FUT8CYP1A2ENPP2MAPK1CYP2C9
SCHEMBL8780029 0.87 ENPP2 (0.49) FUT8CYP1A2ENPP2MAPK1CYP2C9
SCHEMBL11324263 0.86 CYP1A2 (0.49) FUT8CYP1A2ENPP2MAPK1CYP2C9
SCHEMBL8972609 0.86 PRMT1 (0.51) FUT8CYP1A2ENPP2MAPK1CYP2C9
SCHEMBL14499507 0.85 ENPP2 (0.71) FUT8CYP1A2ENPP2MAPK1CYP2C9
SCHEMBL8779954 0.84 ENPP2 (0.67) FUT8CYP1A2ENPP2MAPK1CYP2C9
SCHEMBL10864673 0.82 ENPP2 (0.55) FUT8CYP1A2ENPP2MAPK1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-0481449-B1 Ink compositions for ink jet recording SUMITOMO CHEMICAL CO (JP) 1996-03-27 — — 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
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-0059355-A2 Use of reactive dyestuffs in dyeing and printing of hydroxylgroups containing fibrous materials BAYER AG (DE) 1982-09-08 — — EP 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
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