SCHEMBL8004560

SCHEMBL8004560

CCCCOc1c(OCCCC)c2ccc(NCC)cc2[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.47
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
GPR17 Q13304 1/20 0.38
HSD17B10 Q99714 3/20 0.38
MAPT P10636 3/20 0.38
ESR2 Q92731 1/20 0.38
UNG P13051 2/20 0.37
DRD3 P35462 1/20 0.37
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 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
SCHEMBL7988485 0.96 AR (0.44) ARGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7998801 0.96 AR (0.44) ARGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8001153 0.96 AR (0.44) ARGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8001562 0.95 AR (0.45) ARGPR17HSD17B10MAPTUNG
SCHEMBL7997203 0.95 AR (0.45) ARGPR17HSD17B10MAPTUNG
SCHEMBL7999421 0.91 KDM4E (0.43) ARGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7998822 0.89 AR (0.43) ARGPR17MAPTUNGDRD3
SCHEMBL8000879 0.89 AR (0.43) ARGPR17MAPTUNGDRD3
SCHEMBL7988362 0.89 AR (0.39) ARGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7988791 0.89 AR (0.39) ARGRIN2DGRIN3BGRIN1GRIN2A

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