SCHEMBL9613279

SCHEMBL9613279

Nc1cc(S(=O)(=O)O)c(-c2cc(N=Nc3ccc(N=Nc4ccc(S(=O)(=O)O)cc4)cc3S(=O)(=O)O)c(N)cc2S(=O)(=O)O)cc1N=Nc1ccc(N=Nc2ccc(S(=O)(=O)O)cc2)cc1S(=O)(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SENP2 Q9HC62 7/20 0.51
▸ SENP3 Q9H4L4 6/20 0.51
▸ SENP1 Q9P0U3 6/20 0.51
▸ SUMO2 P61956 4/20 0.51
▸ SUMO1 P63165 4/20 0.51
▸ SENP7 Q9BQF6 4/20 0.51
▸ PHLPP2 Q6ZVD8 3/20 0.51
▸ ENPP2 Q13822 1/20 0.48
▸ CD40 P25942 1/20 0.47
▸ CD40LG P29965 1/20 0.47
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ ATIC P31939 1/20 0.45
▸ RPS6KA3 P51812 1/20 0.45
▸ POLB P06746 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ GLO1 Q04760 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41

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
SCHEMBL9613351 0.93 PHLPP2 (0.53) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL15293561 0.87 PHLPP2 (0.50) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL19982588 0.87 PHLPP2 (0.59) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL15296966 0.81 PHLPP2 (0.54) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL11128580 0.81 ENPP2 (0.54) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL944050 0.81 ENPP2 (0.54) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL15276091 0.80 CYP2C9 (0.71) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL13949386 0.80 ENPP2 (0.54) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL12177954 0.80 SENP2 (0.77) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL15393682 0.80 SENP2 (0.71) SENP2SENP3SENP1SUMO2SUMO1

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-3296363-A1 AZO DYES Kemira Oyj (FI) 2018-03-21 — — EP disclosed
EP-3296362-A1 AZO DYES Kemira Oyj (FI) 2018-03-21 — — EP disclosed
US-8734532-B2 Azo dyes KEMIRA OYJ (FI) 2014-05-27 — — US disclosed
US-20130255006-A1 AZO DYES CHROMASCAPE, LLC 2013-10-03 — — US disclosed
WO-2012072634-A1 AZO DYES KEMIRA OYJ (FI) 2012-06-07 — — WO disclosed
EP-2457956-A1 Azo dyes Kemira Oyj (FI) 2012-05-30 — — EP disclosed
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