SCHEMBL13629237

SCHEMBL13629237

Nc1cc2c(O)c(/N=N/c3ccc(/N=N/c4cc(O)c(/N=N/c5ccc6c(S(=O)(=O)O)cccc6c5)cc4Cl)c4ccc(S(=O)(=O)O)cc34)c(S(=O)(=O)O)cc2cc1S(=O)(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATIC P31939 1/20 0.49
MEN1 O00255 1/20 0.47
THRB P10828 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ENPP2 Q13822 8/20 0.45
CYP1A2 P05177 3/20 0.45
ALDH1A1 P00352 1/20 0.45
HIF1A Q16665 1/20 0.45
SENP3 Q9H4L4 3/20 0.44
SENP2 Q9HC62 3/20 0.44
SENP1 Q9P0U3 3/20 0.44
SUMO2 P61956 2/20 0.44
SUMO1 P63165 2/20 0.44
SENP7 Q9BQF6 2/20 0.44
CD40 P25942 1/20 0.44
CD40LG P29965 1/20 0.44
CYP2C9 P11712 2/20 0.43
MAPK1 P28482 1/20 0.43
DNASE1L3 Q13609 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
SCHEMBL13629236 0.93 ATIC (0.51) ATICENPP2CYP1A2ALDH1A1HIF1A
SCHEMBL13629217 0.92 ATIC (0.54) ATICMEN1THRBKMT2ATDP1
SCHEMBL13629238 0.86 CD40 (0.53) MEN1THRBKMT2ATDP1ENPP2
SCHEMBL13615166 0.85 CYP1A2 (0.39) ATICMEN1THRBKMT2ATDP1
SCHEMBL9777468 0.85 SENP3 (0.53) MEN1THRBKMT2ATDP1ENPP2
SCHEMBL9777466 0.85 SENP3 (0.53) MEN1THRBKMT2ATDP1ENPP2
SCHEMBL9331595 0.85 SENP3 (0.56) MEN1THRBKMT2ATDP1ENPP2
SCHEMBL9331586 0.85 SENP3 (0.56) MEN1THRBKMT2ATDP1ENPP2
SCHEMBL13629244 0.85 ATIC (0.61) ATICMEN1THRBKMT2ATDP1
SCHEMBL13629243 0.84 ATIC (0.55) ATICMEN1THRBKMT2ATDP1

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