SCHEMBL12052972

SCHEMBL12052972

Nc1c(/N=N/c2ccc(S(=O)(=O)CCOSOOO)cc2)cc(/N=N/c2cc(SOOO)c3cccc(S(=O)(=O)O)c3c2)c(N)c1/N=N/c1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SENP2 Q9HC62 3/20 0.36
▸ ATIC P31939 3/20 0.36
▸ SUMO2 P61956 2/20 0.36
▸ SUMO1 P63165 2/20 0.36
▸ SENP7 Q9BQF6 2/20 0.36
▸ ENPP2 Q13822 2/20 0.36
▸ THRB P10828 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ APP P05067 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ SNCA P37840 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ SENP1 Q9P0U3 2/20 0.33
▸ SLC7A11 Q9UPY5 3/20 0.33

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
SCHEMBL12052963 0.98 SUMO2 (0.37) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL12053120 0.93 ATIC (0.35) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL12053114 0.92 ATIC (0.35) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL12052857 0.90 SENP2 (0.37) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL12052520 0.90 THRB (0.38) SENP2SUMO2SUMO1SENP7ENPP2
SCHEMBL12052968 0.90 SUMO2 (0.35) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL12052531 0.89 ATIC (0.35) SENP2ATICSUMO2SUMO1SENP7
SCHEMBL12052811 0.89 THRB (0.42) SENP2SUMO2SUMO1SENP7ENPP2
SCHEMBL12052516 0.89 THRB (0.42) SENP2SUMO2SUMO1SENP7ENPP2
SCHEMBL12052875 0.86 ENPP2 (0.44) SENP2SUMO2SUMO1SENP7ENPP2

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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