SCHEMBL12052963

SCHEMBL12052963

Nc1c(/N=N/c2cc(SOOO)c3cccc(S(=O)(=O)O)c3c2)cc(/N=N/c2ccc(S(=O)(=O)CCOSOOO)cc2S(=O)(=O)O)c(N)c1/N=N/c1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SUMO2 P61956 2/20 0.37
▸ SUMO1 P63165 2/20 0.37
▸ SENP7 Q9BQF6 2/20 0.37
▸ SENP2 Q9HC62 2/20 0.37
▸ ATIC P31939 2/20 0.37
▸ ENPP2 Q13822 2/20 0.34
▸ SENP1 Q9P0U3 1/20 0.33
▸ THRB P10828 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ APP P05067 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX12 P18054 1/20 0.32
▸ SNCA P37840 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ SLC7A11 Q9UPY5 2/20 0.31

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
SCHEMBL12052972 0.98 SENP2 (0.36) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL12053114 0.92 ATIC (0.35) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL12052857 0.92 SENP2 (0.37) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL12052968 0.91 SUMO2 (0.35) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL12053120 0.91 ATIC (0.35) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL13996418 0.88 ENPP2 (0.33) ENPP2THRBPHLPP2
SCHEMBL12052520 0.87 THRB (0.38) SUMO2SUMO1SENP7SENP2ENPP2
SCHEMBL12052531 0.87 ATIC (0.35) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL12052809 0.87 ENPP2 (0.36) SUMO2SUMO1SENP7SENP2ENPP2
SCHEMBL12052811 0.86 THRB (0.42) SUMO2SUMO1SENP7SENP2ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8080101-B2 Azo reactive dyes and mixtures of fiber-reactive azo dyes, their preparation and their use DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2011-12-20 — — US disclosed
US-20080295732-A1 Azo Reactive Dyes And Mixtures Of Fiber-Reactive Azo Dyes, Their Preparation And Their Use DYSTAR TEXTILFARBEN GMBH &CO. DEUTSCHLAND KG (DE) 2008-12-04 — — US disclosed
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