SCHEMBL17323127

SCHEMBL17323127

C=CCc1cccc(Nc2nc(Cl)nc(Nc3ccc(N=Nc4cc(S(=O)(=O)O)c5cccc(S(=O)(=O)O)c5c4)c(C)c3)n2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SENP2 Q9HC62 4/20 0.50
▸ SUMO2 P61956 3/20 0.50
▸ SUMO1 P63165 3/20 0.50
▸ SENP7 Q9BQF6 3/20 0.50
▸ ATIC P31939 2/20 0.50
▸ FUT8 Q9BYC5 1/20 0.37
▸ CA12 O43570 3/20 0.36
▸ CA1 P00915 3/20 0.36
▸ CA2 P00918 3/20 0.36
▸ CA9 Q16790 3/20 0.36
▸ ENPP2 Q13822 1/20 0.34
▸ CHAT P28329 2/20 0.33
▸ ENPP3 O14638 1/20 0.33
▸ ENPP1 P22413 1/20 0.33
▸ CARM1 Q86X55 1/20 0.33
▸ PRMT1 Q99873 1/20 0.33
▸ SENP1 Q9P0U3 3/20 0.33
▸ SENP3 Q9H4L4 2/20 0.33
▸ NFKB1 P19838 1/20 0.32
▸ EGFR P00533 1/20 0.32

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
SCHEMBL17323129 0.91 ENPP2 (0.39) SENP2SUMO2SUMO1SENP7ATIC
SCHEMBL13388803 0.90 SENP2 (0.61) SENP2SUMO2SUMO1SENP7ATIC
SCHEMBL17323133 0.89 ATIC (0.40) SENP2SUMO2SUMO1SENP7ATIC
SCHEMBL17327064 0.88 SENP2 (0.52) SENP2SUMO2SUMO1SENP7ATIC
SCHEMBL3691729 0.88 SENP2 (0.61) SENP2SUMO2SUMO1SENP7ATIC
SCHEMBL3691737 0.88 SENP2 (0.61) SENP2SUMO2SUMO1SENP7ATIC
SCHEMBL17323124 0.88 SENP2 (0.50) SENP2SUMO2SUMO1SENP7ATIC
SCHEMBL15985944 0.88 SENP2 (0.53) SENP2SUMO2SUMO1SENP7ATIC
SCHEMBL29574498 0.87 SENP2 (0.60) SENP2SUMO2SUMO1SENP7ATIC
SCHEMBL13388976 0.83 SENP2 (0.63) SENP2SUMO2SUMO1SENP7ATIC

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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