SCHEMBL13615308

SCHEMBL13615308

Cc1cc(N=Nc2ccc(N=Nc3c(SOOO)cc4cc(S(=O)(=O)O)c(N)cc4c3O)c3cc(S(=O)(=O)O)ccc23)ccc1N=Nc1ccc2c(c1)C(=O)NC2=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
HIF1A Q16665 2/20 0.42
ENPP2 Q13822 7/20 0.41
SENP3 Q9H4L4 4/20 0.41
SENP2 Q9HC62 4/20 0.41
SENP1 Q9P0U3 4/20 0.41
SUMO2 P61956 2/20 0.41
SUMO1 P63165 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
THRB P10828 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTT P42858 1/20 0.38
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PHLPP2 Q6ZVD8 2/20 0.36
CD40 P25942 1/20 0.36
CD40LG P29965 1/20 0.36

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
SCHEMBL13615296 0.96 SENP3 (0.42) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL13615315 0.96 SENP3 (0.42) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL13921654 0.96 SENP3 (0.42) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL13615310 0.90 GLO1 (0.39) ENPP2SENP3SENP2SENP1SUMO2
SCHEMBL13629221 0.89 ENPP2 (0.51) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL13615325 0.88 SENP3 (0.40) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL13615111 0.87 MEN1 (0.42) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL13010288 0.86 ALDH1A1 (0.47) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL13615293 0.85 ENPP2 (0.44) ALDH1A1HIF1AENPP2SENP3SENP2
SCHEMBL13615263 0.85 ALDH1A1 (0.46) ALDH1A1HIF1AENPP2SENP3SENP2

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