SCHEMBL7758370

SCHEMBL7758370

CCN(CC)c1ccc(/N=N/c2cccc(S(=O)(=O)O)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.53
CA2 P00918 4/20 0.53
CA9 Q16790 4/20 0.53
POLB P06746 2/20 0.47
CYP2D6 P10635 1/20 0.47
GLO1 Q04760 1/20 0.47
SENP3 Q9H4L4 2/20 0.46
SENP2 Q9HC62 2/20 0.46
SENP1 Q9P0U3 2/20 0.46
SENP7 Q9BQF6 2/20 0.46
SUMO2 P61956 1/20 0.46
SUMO1 P63165 1/20 0.46
KMT2A Q03164 6/20 0.45
MAPT P10636 4/20 0.45
TDP1 Q9NUW8 4/20 0.45
MAPK1 P28482 2/20 0.45
GAA P10253 1/20 0.45
MEN1 O00255 5/20 0.43
ALDH1A1 P00352 2/20 0.43
HSP90AA1 P07900 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
SCHEMBL7758374 1.00 CA12 (0.53) CA12CA2CA9POLBCYP2D6
SCHEMBL11150292 0.86 CA12 (0.53) CA12CA2CA9GLO1SENP7
SCHEMBL11150290 0.86 CA12 (0.53) CA12CA2CA9GLO1SENP7
SCHEMBL13767349 0.85 TDP1 (0.52) CA12CA2CA9POLBCYP2D6
SCHEMBL1522088 0.85 POLB (0.56) CA12CA2CA9POLBCYP2D6
SCHEMBL1522087 0.85 POLB (0.56) CA12CA2CA9POLBCYP2D6
SCHEMBL13135039 0.84 CA12 (0.42) CA12CA2CA9CYP2D6SENP3
SCHEMBL16163363 0.84 CA12 (0.74) CA12CA2CA9POLBCYP2D6
SCHEMBL30082690 0.84 POLB (0.54) CA12CA2CA9POLBCYP2D6
SCHEMBL1913384 0.84 POLB (0.54) CA12CA2CA9POLBCYP2D6

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036638-A1 Contrast Dyes for Inkjet Lithographic Printing Plates AGFA GRAPHICS NV (BE) 2009-02-05 US disclosed
US-20090036638-A1 Contrast Dyes for Inkjet Lithographic Printing Plates AGFA GRAPHICS NV (BE) 2009-02-05 US disclosed
US-20080280055-A1 Inkjet Lithographic Printing Plates and Method for Their Preparation AGFA GRAPHICS NV (BE) 2008-11-13 US disclosed
US-20080280055-A1 Inkjet Lithographic Printing Plates and Method for Their Preparation AGFA GRAPHICS NV (BE) 2008-11-13 US disclosed
EP-0811506-B1 OPTICAL RECORDING MATERIAL AND OPTICAL RECORDING MEDIUM TOYO INK MFG CO (JP) 2001-03-21 EP disclosed
US-5820962-A COMPRISING PHTHALOCYANINE DYES; EXCELLENT IN RECORDING SENSITIVITY, LIGHT RADIATION RESISTANCE AND DURABILITY TOYO INK MANUFACTURING CO., LTD. (JP) 1998-10-13 US disclosed
EP-0811506-A1 OPTICAL RECORDING MATERIAL AND OPTICAL RECORDING MEDIUM TOYO INK MANUFACTURING CO., LTD. (JP) 1997-12-10 EP disclosed