SCHEMBL7988066

SCHEMBL7988066

CCCCOc1c(O)c2ccc(N)cc2[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.46
KDM4E B2RXH2 7/20 0.43
ALDH1A1 P00352 5/20 0.43
HSD17B10 Q99714 5/20 0.43
HPGD P15428 3/20 0.41
GAA P10253 1/20 0.40
GSK3B P49841 2/20 0.40
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
GPR84 Q9NQS5 1/20 0.38
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL8001710 0.95 GSK3B (0.43) PARP1KDM4EALDH1A1HSD17B10HPGD
SCHEMBL7997301 0.95 GSK3B (0.43) PARP1KDM4EALDH1A1HSD17B10HPGD
SCHEMBL8004454 0.90 PARP1 (0.46) PARP1KDM4EALDH1A1HSD17B10HPGD
SCHEMBL8004352 0.88 PARP1 (0.49) PARP1KDM4EALDH1A1HSD17B10GRIN2D
SCHEMBL8004476 0.85 PARP1 (0.43) PARP1KDM4EALDH1A1HSD17B10HPGD
SCHEMBL8004628 0.85 PARP1 (0.46) PARP1KDM4EALDH1A1GRIN2DGRIN3B
SCHEMBL8001131 0.85 PARP1 (0.46) PARP1KDM4EALDH1A1GRIN2DGRIN3B
SCHEMBL7998930 0.85 PARP1 (0.46) PARP1KDM4EALDH1A1GRIN2DGRIN3B
SCHEMBL8001410 0.85 PARP1 (0.46) PARP1KDM4EALDH1A1HSD17B10GRIN2D
SCHEMBL8001244 0.85 PARP1 (0.46) PARP1KDM4EALDH1A1GRIN2DGRIN3B

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