SCHEMBL8004437

SCHEMBL8004437

CCCCOc1c(OC)c(=O)[nH]c2cc(NC)ccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.40
CNR2 P34972 3/20 0.38
DRD3 P35462 1/20 0.38
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37
ALDH1A1 P00352 4/20 0.36
NPC1 O15118 1/20 0.36
UNG P13051 2/20 0.36
KDM4E B2RXH2 4/20 0.35
MAPT P10636 3/20 0.35
GAA P10253 2/20 0.35
SERPINE1 P05121 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL7999975 0.95 UNG (0.39) ARCNR2DRD3ALDH1A1UNG
SCHEMBL8004359 0.95 AR (0.40) ARCNR2DRD3GRIN2DGRIN3B
SCHEMBL8001316 0.87 AR (0.38) ARCNR2DRD3GRIN2DGRIN3B
SCHEMBL7999685 0.87 AR (0.38) ARCNR2DRD3GRIN2DGRIN3B
SCHEMBL8000599 0.86 KDM4E (0.38) ARCNR2GRIN2DGRIN3BGRIN1
SCHEMBL7988843 0.86 AR (0.48) ARGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7999593 0.83 UNG (0.37) ARGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7997928 0.83 UNG (0.37) ARALDH1A1UNGKDM4EMAPT
SCHEMBL8004560 0.82 AR (0.47) ARDRD3GRIN2DGRIN3BGRIN1
SCHEMBL8001410 0.82 PARP1 (0.46) ARCNR2DRD3GRIN2DGRIN3B

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