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SCHEMBL9613347

SCHEMBL9613347

Nc1cc(N)c(S(=O)(=O)O)cc1N=Nc1ccc(-c2ccc(N=Nc3cc(S(=O)(=O)O)c(N)c(N=Nc4ccc(-c5ccc(N=Nc6cc(S(=O)(=O)O)c(N)cc6N)cc5S(=O)(=O)O)c(S(=O)(=O)O)c4)c3N)cc2S(=O)(=O)O)c(S(=O)(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SENP2 Q9HC62 10/20 0.48
▸ SENP1 Q9P0U3 9/20 0.48
▸ SUMO2 P61956 7/20 0.48
▸ SUMO1 P63165 7/20 0.48
▸ SENP7 Q9BQF6 7/20 0.48
▸ SENP3 Q9H4L4 6/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ APP P05067 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ ALOX12 P18054 1/20 0.47
▸ SNCA P37840 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ ENPP2 Q13822 2/20 0.43
▸ SLC7A11 Q9UPY5 3/20 0.42

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
SCHEMBL9613364 0.90 SENP2 (0.50) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15293564 0.89 ALDH1A1 (0.45) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL9613349 0.87 ENPP2 (0.54) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL9613346 0.86 SENP2 (0.54) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL9613385 0.84 ENPP2 (0.60) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15296886 0.82 ENPP2 (0.50) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL19982683 0.81 ENPP2 (0.49) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15743526 0.80 SENP2 (0.46) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15293544 0.79 TDP1 (0.46) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL19982588 0.79 PHLPP2 (0.59) SENP2SENP1SUMO2SUMO1SENP7

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-3296362-A1 AZO DYES Kemira Oyj (FI) 2018-03-21 — — EP disclosed
EP-3296363-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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