SCHEMBL13823298

SCHEMBL13823298

C=CS(=O)(=O)c1ccc(Nc2nc(Cl)nc(Nc3ccc(N=Nc4c(N)ccc5cc(S(=O)(=O)O)cc(O)c45)c(S(=O)(=O)O)c3)n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 3/20 0.61
▸ FUT8 Q9BYC5 1/20 0.51
▸ PRMT1 Q99873 2/20 0.47
▸ APEX1 P27695 3/20 0.47
▸ SUMO2 P61956 2/20 0.45
▸ SUMO1 P63165 2/20 0.45
▸ SENP7 Q9BQF6 2/20 0.45
▸ SENP2 Q9HC62 2/20 0.45
▸ CHAT P28329 3/20 0.41
▸ USP2 O75604 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ENPP3 O14638 1/20 0.38
▸ ENPP1 P22413 1/20 0.38
▸ CA12 O43570 3/20 0.37
▸ CA1 P00915 3/20 0.37
▸ CA2 P00918 3/20 0.37
▸ CA9 Q16790 3/20 0.37

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
SCHEMBL14440892 1.00 ENPP2 (0.61) ENPP2FUT8PRMT1APEX1SUMO2
SCHEMBL14038374 0.92 ENPP2 (0.69) ENPP2FUT8PRMT1APEX1SUMO2
SCHEMBL17323141 0.91 ENPP2 (0.49) ENPP2FUT8PRMT1APEX1SUMO2
SCHEMBL14048509 0.91 ENPP2 (0.62) ENPP2FUT8PRMT1APEX1SUMO2
SCHEMBL12189797 0.90 ENPP2 (0.62) ENPP2FUT8PRMT1APEX1SUMO2
SCHEMBL17384128 0.90 ENPP2 (0.51) ENPP2FUT8PRMT1APEX1SUMO2
SCHEMBL17384264 0.89 FUT8 (0.51) ENPP2FUT8PRMT1APEX1SUMO2
SCHEMBL17384214 0.89 ENPP2 (0.52) ENPP2FUT8PRMT1APEX1SUMO2
SCHEMBL12189798 0.87 ENPP2 (0.60) ENPP2FUT8PRMT1APEX1SUMO2
SCHEMBL16330379 0.86 ENPP2 (0.59) ENPP2FUT8PRMT1APEX1SUMO2

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-1687478-B1 METHOD OF DYEING OR PRINTING TEXTILE FIBRE MATERIALS USING REACTIVE DYES HUNTSMAN ADV MAT SWITZERLAND (CH) 2012-12-19 — — EP disclosed
US-7553339-B2 Bringing fiber material into contact with at least one reactive dye containing at least one anionic group, at least one compound which reduces the ionic character of the anionic group, and at least one nucleophilic compound; yields dyeings or prints having deep hues and very good fastness HUNTSMAN INTERNATIONAL LLC (US) 2009-06-30 — — US disclosed
US-7396370-B2 Method of dyeing or printing synthetic polyamide fibre materials using reactive dyes HUNTSMAN INTERNATIONAL LLC (US) 2008-07-08 — — US disclosed
US-7259259-B2 Reactive dyes, a process for their preparation and their use HUNTSMAN INTERNATIONAL LLC (US) 2007-08-21 — — US disclosed
US-20070130703-A1 Bringing fiber material into contact with at least one reactive dye containing at least one anionic group, at least one compound which reduces the ionic character of the anionic group, and at least one nucleophilic compound; yields dyeings or prints having deep hues and very good fastness CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-06-14 — — US disclosed
EP-1275700-B1 Process of trichromic dyeing or printing of synthetic polyamide materials HUNTSMAN ADV MAT SWITZERLAND (CH) 2007-02-28 — — EP disclosed
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