SCHEMBL8972609

SCHEMBL8972609

CNCC(=O)Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(N=Nc3cc(S(=O)(=O)O)cc(Cl)c3O)c(O)c12

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 1/20 0.51
▸ FUT8 Q9BYC5 1/20 0.49
▸ ENPP2 Q13822 6/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CYP1A2 P05177 2/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ DNASE1L3 Q13609 1/20 0.43
▸ CA2 P00918 3/20 0.40
▸ CA1 P00915 2/20 0.40
▸ PHLPP2 Q6ZVD8 2/20 0.40
▸ CD40 P25942 1/20 0.38
▸ CD40LG P29965 1/20 0.38
▸ CA3 P07451 1/20 0.35
▸ APEX1 P27695 1/20 0.35

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 0.88 PRMT1 (0.54) PRMT1FUT8ENPP2MEN1HTT
SCHEMBL8779901 0.86 FUT8 (0.59) PRMT1FUT8ENPP2MEN1HTT
SCHEMBL8779959 0.83 ENPP2 (0.63) PRMT1FUT8ENPP2MEN1HTT
SCHEMBL8780029 0.82 ENPP2 (0.49) PRMT1FUT8ENPP2MEN1HTT
SCHEMBL8779954 0.82 ENPP2 (0.67) PRMT1FUT8ENPP2MEN1HTT
SCHEMBL8779895 0.81 CYP1A2 (0.54) PRMT1FUT8ENPP2MEN1HTT
SCHEMBL11324263 0.81 CYP1A2 (0.49) PRMT1FUT8ENPP2MEN1HTT
SCHEMBL10864673 0.80 ENPP2 (0.55) PRMT1FUT8ENPP2MEN1HTT
SCHEMBL8779867 0.78 ENPP2 (0.55) PRMT1FUT8ENPP2MEN1HTT
SCHEMBL9135613 0.77 MEN1 (0.66) PRMT1FUT8ENPP2MEN1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0481449-B1 Ink compositions for ink jet recording SUMITOMO CHEMICAL CO (JP) 1996-03-27 — — EP 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-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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