SCHEMBL8001709

SCHEMBL8001709

CCCCCCOc1c(O)c2ccc(NCCCC)cc2n(C)c1=O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 1/20 0.42
GSK3B P49841 9/20 0.42
AR P10275 1/20 0.37
CNR2 P34972 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL8004439 0.98 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL8001338 0.96 KDM4E (0.40) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL7988965 0.91 GSK3B (0.40) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL8000560 0.90 AR (0.39) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL7988882 0.89 GSK3B (0.40) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL8001104 0.89 AR (0.38) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL7988945 0.89 AR (0.38) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL7988963 0.88 GSK3B (0.42) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL6582077 0.88 GSK3B (0.42) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL7998792 0.88 GSK3B (0.42) KDM4EALDH1A1HPGDHSD17B10GSK3B

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