SCHEMBL8092232

SCHEMBL8092232

Nc1c(Sc2ccccc2)cc(Nc2ccccc2)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.68
P2RY12 Q9H244 11/20 0.63
P2RY4 P51582 10/20 0.63
P2RY2 P41231 8/20 0.60
P2RY6 Q15077 6/20 0.60
P2RY1 P47900 5/20 0.60
CDK2 P24941 2/20 0.60
GNG2 P59768 3/20 0.51
GNB1 P62873 3/20 0.51
MET P08581 2/20 0.51
HGF P14210 2/20 0.51
ENTPD1 P49961 1/20 0.49

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
SCHEMBL16473103 0.85 P2RY12 (0.61) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL13320762 0.82 P2RY12 (0.57) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL13944330 0.82 ADORA2A (1.00) ADORA2AP2RY12P2RY4P2RY2P2RY6
SCHEMBL8092263 0.80 ADORA2A (0.80) ADORA2AP2RY12P2RY4P2RY2P2RY6
SCHEMBL13213978 0.78 P2RY4 (0.78) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL12837489 0.78 P2RY4 (0.65) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL11756141 0.78 P2RY4 (0.65) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL8731432 0.78 ADORA2A (0.76) ADORA2AP2RY12P2RY4
SCHEMBL13320763 0.78 P2RY4 (0.65) P2RY12P2RY4P2RY2P2RY6P2RY1
SCHEMBL12593742 0.78 P2RY12 (0.72) P2RY12P2RY4P2RY2P2RY6P2RY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6051360-A A REACTION PRODUCT OF A CHROMOPHORIC NUCLEUS AND A BISPHENOL; EXCELLENT SOLUBILITY IN SOLVENTS AND BINDER RESINS; COLOR FILTERS FOR DISPLAY DEVICES SUCH AS LIQUID CRYSTAL TELEVISION AND COLOR SEPARATION FILTERS FOR IMAGE PICKUP TUBES MITSUI CHEMICALS, INC. (JP) 2000-04-18 US disclosed
EP-0633296-B1 Novel dyestuffs and their use MITSUI CHEMICALS INC (JP) 1999-10-13 EP disclosed
US-5773172-A SOLVENT AND BINDER SOLUBILITY MITSUI TOATSU CHEMICALS, INC. (JP) 1998-06-30 US disclosed
EP-0633296-A1 Novel dyestuffs and their use MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-01-11 EP disclosed