SCHEMBL13615307

SCHEMBL13615307

Nc1cc2c(O)c(N=Nc3ccc(N=Nc4ccc5[nH]c(=O)[nH]c5c4)c4ccccc34)c(SOOO)cc2cc1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 2/20 0.41
SENP2 Q9HC62 5/20 0.40
SENP1 Q9P0U3 5/20 0.40
SENP3 Q9H4L4 4/20 0.40
SUMO2 P61956 3/20 0.40
SUMO1 P63165 3/20 0.40
SENP7 Q9BQF6 3/20 0.40
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PHLPP2 Q6ZVD8 1/20 0.37
ENPP2 Q13822 2/20 0.35
GLO1 Q04760 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
HIF1A Q16665 1/20 0.35
ATIC P31939 1/20 0.35
CTRB1 P17538 1/20 0.34
SLC7A11 Q9UPY5 2/20 0.33

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
SCHEMBL13615301 0.93 SENP3 (0.41) PTPN11SENP2SENP1SENP3SUMO2
SCHEMBL13615290 0.92 PTPN11 (0.47) PTPN11SENP2SENP1SENP3SUMO2
SCHEMBL13615319 0.89 ENPP2 (0.40) PTPN11MEN1THRBKMT2ATDP1
SCHEMBL13629224 0.88 SENP2 (0.46) SENP2SENP1SENP3SUMO2SUMO1
SCHEMBL13615117 0.86 SENP3 (0.40) PTPN11SENP2SENP1SENP3SUMO2
SCHEMBL13615147 0.86 ATIC (0.51) PTPN11SENP2SENP1SENP3SUMO2
SCHEMBL13615112 0.81 PTPN11 (0.49) PTPN11SENP2SENP1SENP3SUMO2
SCHEMBL13860879 0.81 PHLPP2 (0.47) PTPN11SENP2SENP1SENP3SUMO2
SCHEMBL13615135 0.81 ATIC (0.47) PTPN11SENP2SENP1SENP3SUMO2
SCHEMBL13615173 0.81 GLO1 (0.41) PTPN11SENP2SENP1SENP3SUMO2

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
US-20090275742-A1 COLORING MATTER FOR ANISOTROPIC COLORING MATTER FILM, COMPOSITION COMPRISING SAID COLORING MATTER, ANISOTROPIC COLORING MATTER FILM, AND POLARIZING ELEMENT MITSUBISHI CHEMICAL CORPORATION (JP) 2009-11-05 US disclosed