SCHEMBL7988841

SCHEMBL7988841

CCCCNc1ccc2c(O)c(OC)c(=O)n(C)c2c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
GAA P10253 1/20 0.41
GSK3B P49841 2/20 0.39
AR P10275 1/20 0.39
HIF1A Q16665 4/20 0.38
HPGD P15428 2/20 0.38
PGR P06401 2/20 0.37
RORA P35398 1/20 0.37
RORC P51449 1/20 0.37
RORB Q92753 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CNR2 P34972 2/20 0.36
EGFR P00533 1/20 0.36
ATM Q13315 1/20 0.36
CYP1A2 P05177 1/20 0.36
XBP1 P17861 1/20 0.36
CRBN Q96SW2 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
SCHEMBL6582077 0.95 GSK3B (0.42) KDM4EALDH1A1GAAGSK3BHIF1A
SCHEMBL7998792 0.95 GSK3B (0.42) KDM4EALDH1A1GAAGSK3BHIF1A
SCHEMBL7988963 0.95 GSK3B (0.42) KDM4EALDH1A1GAAGSK3BHIF1A
SCHEMBL8001338 0.90 KDM4E (0.40) KDM4EALDH1A1GAAGSK3BAR
SCHEMBL7988001 0.88 GSK3B (0.38) KDM4EALDH1A1GAAGSK3BAR
SCHEMBL8001709 0.88 KDM4E (0.42) KDM4EALDH1A1GSK3BARHPGD
SCHEMBL7978061 0.86 GSK3B (0.42) KDM4EALDH1A1GAAGSK3BHPGD
SCHEMBL8000873 0.86 GSK3B (0.40) KDM4EALDH1A1GAAGSK3BAR
SCHEMBL8004439 0.85 KDM4E (0.42) KDM4EALDH1A1GSK3BHPGDHSD17B10
SCHEMBL8004390 0.85 AR (0.38) ALDH1A1ARHIF1APGRRORA

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