SCHEMBL17323130

SCHEMBL17323130

CCCS(=O)(=O)c1ccc(Nc2nc(Cl)nc(Nc3ccc(N=Nc4cc(S(=O)(=O)O)c5cccc(S(=O)(=O)O)c5c4)c(C)c3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATIC P31939 2/20 0.51
▸ SENP2 Q9HC62 2/20 0.51
▸ SUMO2 P61956 1/20 0.51
▸ SUMO1 P63165 1/20 0.51
▸ SENP7 Q9BQF6 1/20 0.51
▸ FUT8 Q9BYC5 1/20 0.40
▸ CA12 O43570 7/20 0.40
▸ CA1 P00915 7/20 0.40
▸ CA2 P00918 7/20 0.40
▸ CA9 Q16790 7/20 0.40
▸ ENPP2 Q13822 4/20 0.38
▸ CHAT P28329 3/20 0.36
▸ USP2 O75604 1/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ CARM1 Q86X55 1/20 0.34
▸ PRMT1 Q99873 1/20 0.34
▸ CA14 Q9ULX7 3/20 0.34
▸ SENP3 Q9H4L4 1/20 0.34
▸ SENP1 Q9P0U3 1/20 0.34
▸ ENPP3 O14638 1/20 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
SCHEMBL17327072 0.92 ATIC (0.49) ATICSENP2SUMO2SUMO1SENP7
SCHEMBL17323126 0.91 ENPP2 (0.42) ATICSENP2SUMO2SUMO1SENP7
SCHEMBL13388803 0.90 SENP2 (0.61) ATICSENP2SUMO2SUMO1SENP7
SCHEMBL3691737 0.89 SENP2 (0.61) ATICSENP2SUMO2SUMO1SENP7
SCHEMBL3691729 0.89 SENP2 (0.61) ATICSENP2SUMO2SUMO1SENP7
SCHEMBL15985944 0.88 SENP2 (0.53) ATICSENP2SUMO2SUMO1SENP7
SCHEMBL29574498 0.88 SENP2 (0.60) ATICSENP2SUMO2SUMO1SENP7
SCHEMBL17323124 0.87 SENP2 (0.50) ATICSENP2SUMO2SUMO1SENP7
SCHEMBL15985955 0.87 SENP2 (0.48) ATICSENP2SUMO2SUMO1SENP7
SCHEMBL13151926 0.85 ATIC (0.51) ATICSENP2SUMO2SUMO1SENP7

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-9540765-B2 Mixtures of reactive dyes and their use in a method of di- or trichromatic dyeing or printing HUNTSMAN INTERNATIONAL LLC (US) 2017-01-10 — — US disclosed
US-20150354134-A1 Mixtures of Reactive Dyes and Their Use in a Method of Di- or Trichromatic Dyeing or Printing HUNTSMAN INTERNATIONAL LLC 2015-12-10 — — US disclosed
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