SCHEMBL8000708

SCHEMBL8000708

Nc1ccc2c(O)c(OC=O)c(=O)[nH]c2c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.50
AR P10275 1/20 0.38
GRIN2D O15399 2/20 0.37
GRIN3B O60391 2/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2A Q12879 2/20 0.37
GRIN2B Q13224 2/20 0.37
GRIN2C Q14957 2/20 0.37
GRIN3A Q8TCU5 2/20 0.37
SRC P12931 1/20 0.36
PRKACA P17612 1/20 0.36
PRKACG P22612 1/20 0.36
PRKACB P22694 1/20 0.36
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36

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
SCHEMBL8004373 0.82 PARP1 (0.53) PARP1ARGRIN2DGRIN3BGRIN1
SCHEMBL8004588 0.82 PARP1 (0.49) PARP1ARGRIN2DGRIN3BGRIN1
SCHEMBL8004541 0.80 AR (0.42) ARGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7988987 0.79 PARP1 (0.49) PARP1ARGRIN2DGRIN3BGRIN1
SCHEMBL7997730 0.79 PARP1 (0.49) PARP1ARGRIN2DGRIN3BGRIN1
SCHEMBL7988937 0.79 PARP1 (0.55) PARP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7989258 0.79 PARP1 (0.46) PARP1ARGRIN2DGRIN3BGRIN1
SCHEMBL8001080 0.78 PARP1 (0.62) PARP1ARGRIN2DGRIN3BGRIN1
SCHEMBL8000846 0.76 PARP1 (0.41) PARP1AR
SCHEMBL8000842 0.76 PARP1 (0.41) PARP1AR

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-6114352-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-09-05 US disclosed
EP-0785190-B1 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-08-16 EP disclosed
US-5942521-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-08-24 US disclosed
EP-0785190-A2 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-07-23 EP disclosed