SCHEMBL12028010

SCHEMBL12028010

Cc1ccc(N=Nc2c(N)c(N=Nc3ccc(S(=O)(=O)O)cc3C(=O)O)cc(S(=O)(=O)O)c2N)c(C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 4/20 0.55
▸ ENPP2 Q13822 3/20 0.52
▸ SENP2 Q9HC62 5/20 0.48
▸ SENP1 Q9P0U3 5/20 0.48
▸ SUMO2 P61956 4/20 0.48
▸ SUMO1 P63165 4/20 0.48
▸ SENP7 Q9BQF6 4/20 0.48
▸ SENP3 Q9H4L4 3/20 0.48
▸ ALDH1A1 P00352 5/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ PTPN11 Q06124 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ HPGD P15428 3/20 0.40
▸ APP P05067 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ THRB P10828 2/20 0.40
▸ SNCA P37840 2/20 0.40
▸ RECQL P46063 2/20 0.40

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
SCHEMBL12028003 0.93 ENPP2 (0.52) PHLPP2ENPP2SENP2SENP1SUMO2
SCHEMBL12028012 0.80 ENPP2 (0.50) PHLPP2ENPP2SENP2SENP1SUMO2
SCHEMBL12028027 0.79 ALDH1A1 (0.49) PHLPP2ENPP2SENP2SENP1SUMO2
SCHEMBL15044909 0.79 SUMO2 (0.50) PHLPP2ENPP2SENP2SENP1SUMO2
SCHEMBL16170765 0.78 PHLPP2 (0.55) PHLPP2ENPP2SENP2SENP1SUMO2
SCHEMBL16170764 0.78 SENP2 (0.60) PHLPP2ENPP2SENP2SENP1SUMO2
SCHEMBL12028007 0.76 ALDH1A1 (0.46) PHLPP2ENPP2SENP2SENP1SUMO2
SCHEMBL12028004 0.76 ENPP2 (0.54) PHLPP2ENPP2SENP2SENP1SUMO2
SCHEMBL14024913 0.75 PTPN11 (0.43) PHLPP2ENPP2SENP2SENP1SUMO2
SCHEMBL15044918 0.74 MEN1 (0.56) PHLPP2ENPP2SENP2SENP1SUMO2

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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