SCHEMBL13960076

SCHEMBL13960076

CC(=O)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 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CD40 P25942 1/20 0.66
CD40LG P29965 1/20 0.66
PRMT1 Q99873 2/20 0.56
PRMT3 O60678 1/20 0.56
EP300 Q09472 1/20 0.56
PRMT6 Q96LA8 1/20 0.56
ENPP2 Q13822 10/20 0.54
CA2 P00918 1/20 0.53
CA3 P07451 1/20 0.53
AMY1A P0DUB6 3/20 0.51
MEN1 O00255 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL13959649 0.93 PRMT1 (0.55) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL13959558 0.91 CD40 (0.55) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL13937858 0.89 CD40 (0.54) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL13959648 0.87 PRMT1 (0.54) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL13959636 0.87 PRMT1 (0.50) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL8779936 0.86 MEN1 (0.65) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL30843979 0.84 PRMT1 (0.64) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL13959653 0.82 PRMT1 (0.48) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL3266745 0.82 ENPP2 (0.65) CD40CD40LGPRMT1PRMT3EP300
SCHEMBL18135178 0.82 ENPP2 (0.65) CD40CD40LGPRMT1PRMT3EP300

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