SCHEMBL12028003

SCHEMBL12028003

Nc1c(N=Nc2ccc(S(=O)(=O)O)cc2C(=O)O)cc(S(=O)(=O)O)c(N)c1N=Nc1ccc(S(=O)(=O)O)cc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 2/20 0.52
▸ PHLPP2 Q6ZVD8 2/20 0.48
▸ SENP2 Q9HC62 4/20 0.47
▸ SENP1 Q9P0U3 4/20 0.47
▸ SUMO2 P61956 3/20 0.47
▸ SUMO1 P63165 3/20 0.47
▸ SENP7 Q9BQF6 3/20 0.47
▸ SENP3 Q9H4L4 3/20 0.47
▸ PTPN11 Q06124 1/20 0.45
▸ ALDH1A1 P00352 5/20 0.43
▸ HPGD P15428 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ THRB P10828 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ APP P05067 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ SNCA P37840 2/20 0.43

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
SCHEMBL12028010 0.93 PHLPP2 (0.55) ENPP2PHLPP2SENP2SENP1SUMO2
SCHEMBL15044909 0.85 SUMO2 (0.50) ENPP2PHLPP2SENP2SENP1SUMO2
SCHEMBL15044918 0.80 MEN1 (0.56) ENPP2PHLPP2SENP2SENP1SUMO2
SCHEMBL15044915 0.80 MEN1 (0.56) ENPP2PHLPP2SENP2SENP1SUMO2
SCHEMBL15044927 0.79 PTPN11 (0.47) ENPP2PHLPP2SENP2SENP1SUMO2
SCHEMBL15044911 0.79 PTPN11 (0.47) ENPP2PHLPP2SENP2SENP1SUMO2
SCHEMBL12028004 0.79 ENPP2 (0.54) ENPP2PHLPP2SENP2SENP1SUMO2
SCHEMBL12028020 0.79 ENPP2 (0.52) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16170764 0.79 SENP2 (0.60) ENPP2PHLPP2SENP2SENP1SUMO2
SCHEMBL14400893 0.77 CYP1A2 (0.42) ENPP2PHLPP2PTPN11ALDH1A1HPGD

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-8465577-B2 Blue, red, and yellow dye compounds, and black ink composition comprising the same EVERLIGHT USA, INC. (US) 2013-06-18 — — US disclosed
US-20110308425-A1 BLUE, RED, AND YELLOW DYE COMPOUNDS, AND BLACK INK COMPOSITION COMPRISING THE SAME EVERLIGHT USA, INC. (US) 2011-12-22 — — US disclosed
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