SCHEMBL8004890

SCHEMBL8004890

CC=C(CC)Oc1c(OC)c(=O)n(CC)c2cc(N)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.39
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 4/20 0.39
GAA P10253 1/20 0.39
GFER P55789 1/20 0.39
SRC P12931 2/20 0.34
MAPK1 P28482 2/20 0.33
HTT P42858 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 1/20 0.33
HBB P68871 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
METAP2 P50579 4/20 0.33
TTR P02766 1/20 0.32
MDM2 Q00987 1/20 0.32
ACSS2 Q9NR19 1/20 0.32
ATAD2 Q6PL18 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL8004253 0.91 KDM4E (0.38) MAPTKDM4EALDH1A1GAAGFER
SCHEMBL8001107 0.89 PGR (0.37) KDM4EALDH1A1MAPK1HSD17B10MEN1
SCHEMBL7998663 0.89 KDM4E (0.39) MAPTKDM4EALDH1A1GAAGFER
SCHEMBL7998916 0.88 KDM4E (0.37) MAPTKDM4EALDH1A1GAAGFER
SCHEMBL7989073 0.87 KDM4E (0.41) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL7989014 0.87 KDM4E (0.41) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL7998775 0.87 ALDH1A1 (0.40) MAPTKDM4EALDH1A1GAAGFER
SCHEMBL8003956 0.87 TTR (0.42) MAPTKDM4EALDH1A1GAAGFER
SCHEMBL8001062 0.87 ALDH1A1 (0.36) MAPTKDM4EALDH1A1GAAGFER
SCHEMBL7999012 0.86 KDM4E (0.41) MAPTKDM4EALDH1A1GAAGFER

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