SCHEMBL5590890

SCHEMBL5590890

O=S(=O)(O)c1cc2cc(S(=O)(=O)O)c(/N=N/c3ccccc3)c(O)c2c(O)c1/N=N/c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 6/20 0.58
CYP1A2 P05177 3/20 0.54
PRMT1 Q99873 2/20 0.54
PRMT3 O60678 1/20 0.54
EP300 Q09472 1/20 0.54
PRMT6 Q96LA8 1/20 0.54
CYP2C9 P11712 1/20 0.53
MAPK1 P28482 1/20 0.53
DNASE1L3 Q13609 1/20 0.53
POLB P06746 1/20 0.51
CYP2D6 P10635 1/20 0.51
PHLPP2 Q6ZVD8 1/20 0.51
SUMO2 P61956 2/20 0.46
SUMO1 P63165 2/20 0.46
SENP7 Q9BQF6 2/20 0.46
SENP2 Q9HC62 2/20 0.46
SENP1 Q9P0U3 1/20 0.46
MEN1 O00255 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL5590892 1.00 ENPP2 (0.58) ENPP2CYP1A2PRMT1PRMT3EP300
SCHEMBL9234257 0.90 ENPP2 (0.70) ENPP2CYP1A2PRMT1PRMT3EP300
SCHEMBL9234263 0.90 ENPP2 (0.70) ENPP2CYP1A2PRMT1PRMT3EP300
SCHEMBL5351119 0.88 CYP1A2 (0.71) ENPP2CYP1A2PRMT1PRMT3EP300
SCHEMBL5351115 0.88 CYP1A2 (0.71) ENPP2CYP1A2PRMT1PRMT3EP300
SCHEMBL5859444 0.87 CYP1A2 (0.70) ENPP2CYP1A2PRMT1PRMT3EP300
SCHEMBL11696125 0.87 ENPP2 (0.67) ENPP2CYP1A2PRMT1PRMT3EP300
SCHEMBL11759436 0.87 CYP1A2 (0.70) ENPP2CYP1A2PRMT1PRMT3EP300
SCHEMBL16303862 0.87 ENPP2 (0.67) ENPP2CYP1A2PRMT1PRMT3EP300
SCHEMBL12943030 0.87 PRMT3 (0.61) ENPP2CYP1A2PRMT1PRMT3EP300

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
JP-2007322336-A CALCIUM-MEASURING REAGENT AND CALCIUM-MEASURING METHOD MITSUBISHI KAGAKU IATRON INC 2007-12-13 JP disclosed