SCHEMBL13959639

SCHEMBL13959639

Nc1ccc(/N=N/c2c(S(=O)(=O)O)cc3cc(S(=O)(=O)O)c(/N=N/c4ccc(S(=O)(=O)O)cc4)c(O)c3c2O)c(S(=O)(=O)O)c1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CD40 P25942 1/20 0.56
CD40LG P29965 1/20 0.56
CYP1A2 P05177 2/20 0.54
ENPP2 Q13822 7/20 0.54
MEN1 O00255 1/20 0.54
HTT P42858 1/20 0.54
KMT2A Q03164 1/20 0.54
PRMT1 Q99873 1/20 0.53
PHLPP2 Q6ZVD8 2/20 0.52
SUMO2 P61956 1/20 0.51
SUMO1 P63165 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP2 Q9HC62 1/20 0.51
CYP2C9 P11712 1/20 0.48
MAPK1 P28482 1/20 0.48
DNASE1L3 Q13609 1/20 0.48
ATIC P31939 1/20 0.46
APEX1 P27695 1/20 0.45

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
SCHEMBL10393301 0.95 ENPP2 (0.58) CD40CD40LGCYP1A2ENPP2MEN1
SCHEMBL10393912 0.95 ENPP2 (0.58) CD40CD40LGCYP1A2ENPP2MEN1
SCHEMBL13959650 0.93 CYP1A2 (0.59) CD40CD40LGCYP1A2ENPP2MEN1
SCHEMBL13959116 0.90 PRMT1 (0.58) CD40CD40LGCYP1A2ENPP2MEN1
SCHEMBL13937860 0.89 CD40 (0.47) CD40CD40LGCYP1A2ENPP2MEN1
SCHEMBL10647786 0.87 ENPP2 (0.55) CD40CD40LGCYP1A2ENPP2MEN1
SCHEMBL11128580 0.87 ENPP2 (0.54) CD40CD40LGCYP1A2ENPP2MEN1
SCHEMBL944050 0.87 ENPP2 (0.54) CD40CD40LGCYP1A2ENPP2MEN1
SCHEMBL12511365 0.86 CYP1A2 (0.72) CD40CD40LGCYP1A2ENPP2MEN1
SCHEMBL10392749 0.86 ENPP2 (0.57) CD40CD40LGCYP1A2ENPP2MEN1

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-7481522-B2 Compositions and inks containing disazo dyes FUJIFILM IMAGING COLORANTS LIMITED (GB) 2009-01-27 US disclosed