SCHEMBL13629442

SCHEMBL13629442

Cc1cc(C(N)=O)ccc1N=Nc1ccc(N=Nc2c(S(=O)(=O)O)cc3cc(S(=O)(=O)O)c(N)cc3c2O)c2cc(S(=O)(=O)O)ccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.53
HIF1A Q16665 2/20 0.53
SENP3 Q9H4L4 3/20 0.51
SENP2 Q9HC62 3/20 0.51
SENP1 Q9P0U3 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
SUMO2 P61956 2/20 0.51
SUMO1 P63165 2/20 0.51
SENP7 Q9BQF6 2/20 0.51
HTT P42858 1/20 0.51
ENPP2 Q13822 8/20 0.51
THRB P10828 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PHLPP2 Q6ZVD8 1/20 0.46
CD40 P25942 1/20 0.44
CD40LG P29965 1/20 0.44
USP2 O75604 1/20 0.43
PTPN1 P18031 1/20 0.43
ATM Q13315 1/20 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
SCHEMBL14339110 0.94 ENPP2 (0.50) ALDH1A1HIF1ASENP3SENP2SENP1
SCHEMBL9332191 0.92 ALDH1A1 (0.59) ALDH1A1HIF1ASENP3SENP2SENP1
SCHEMBL9332206 0.92 ALDH1A1 (0.59) ALDH1A1HIF1ASENP3SENP2SENP1
SCHEMBL13629259 0.90 CD40 (0.52) ALDH1A1HIF1ASENP3SENP2SENP1
SCHEMBL13615263 0.89 ALDH1A1 (0.46) ALDH1A1HIF1ASENP3SENP2SENP1
SCHEMBL13629437 0.89 MEN1 (0.46) ALDH1A1HIF1ASENP3SENP2SENP1
SCHEMBL13629441 0.88 ENPP2 (0.53) ALDH1A1HIF1ASENP3SENP2SENP1
SCHEMBL13629282 0.87 CD40 (0.49) ALDH1A1HIF1ASENP3SENP2SENP1
SCHEMBL13629309 0.85 ALDH1A1 (0.52) ALDH1A1HIF1ASENP3SENP2SENP1
SCHEMBL14339183 0.85 SENP3 (0.57) ALDH1A1HIF1ASENP3SENP2SENP1

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-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
EP-1867684-A1 COLORING MATTER FOR ANISOTROPIC COLORING MATTER FILM, COMPOSITION COMPRISING SAID COLORING MATTER, ANISOTROPIC COLORING MATTER FILM, AND POLARIZING ELEMENT Mitsubishi Chemical Corporation (JP) 2007-12-19 EP disclosed