SCHEMBL12559107

SCHEMBL12559107

COc1cc(Nc2nc(O)nc(Nc3cc(OC)c(/N=N/c4cc(S(=O)(=O)O)c5cccc(S(=O)(=O)O)c5c4)cc3OC)n2)c(OC)cc1/N=N/c1cc(S(=O)(=O)O)c2cccc(S(=O)(=O)O)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SUMO2 P61956 3/20 0.47
▸ SUMO1 P63165 3/20 0.47
▸ SENP7 Q9BQF6 3/20 0.47
▸ SENP2 Q9HC62 3/20 0.47
▸ ATIC P31939 2/20 0.47
▸ MPL P40238 2/20 0.38
▸ PHLPP2 Q6ZVD8 1/20 0.37
▸ ENPP2 Q13822 2/20 0.36
▸ CYP1A2 P05177 2/20 0.35
▸ MEN1 O00255 6/20 0.35
▸ KMT2A Q03164 6/20 0.35
▸ BLM P54132 4/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ MAPT P10636 4/20 0.35
▸ THRB P10828 3/20 0.35
▸ MAPK1 P28482 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ RECQL P46063 2/20 0.35
▸ TDP1 Q9NUW8 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35

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
SCHEMBL13388669 0.96 SENP2 (0.48) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL12558897 0.92 ATIC (0.45) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL13151900 0.84 SENP2 (0.40) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL14401868 0.83 SENP2 (0.52) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL17813910 0.83 ATIC (0.40) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL13388929 0.82 SENP2 (0.57) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL12848431 0.82 ATIC (0.38) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL14528570 0.81 ATIC (0.42) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL13388834 0.80 ATIC (0.47) SUMO2SUMO1SENP7SENP2ATIC
SCHEMBL13151859 0.80 ENPP2 (0.47) SUMO2SUMO1SENP7SENP2ATIC

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1920008-B1 DISAZODYES FOR INK-JET PRINTING FUJIFILM IMAGING COLORANTS LTD (GB) 2011-06-15 — — EP disclosed
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