SCHEMBL7997782

SCHEMBL7997782

C=CCOc1c(O)c2ccc(NCCCCCCCC)cc2n(C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 9/20 0.39
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 1/20 0.35
ABL1 P00519 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ADRA2A P08913 1/20 0.33
HIF1A Q16665 1/20 0.33

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 0.89 KDM4E (0.42) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7988502 0.88 KDM4E (0.35) GSK3BKDM4EALDH1A1HPGDABL1
SCHEMBL8004028 0.88 ABL1 (0.34) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8004491 0.88 ABL1 (0.34) GSK3BKDM4EALDH1A1ABL1MEN1
SCHEMBL8001527 0.87 ABL1 (0.33) GSK3BKDM4EALDH1A1HPGDABL1
SCHEMBL8001709 0.87 KDM4E (0.42) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8001531 0.86 TERT (0.32) GSK3BKDM4EALDH1A1HPGDABL1
SCHEMBL7988963 0.86 GSK3B (0.42) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL6582077 0.86 GSK3B (0.42) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7998792 0.86 GSK3B (0.42) GSK3BKDM4EALDH1A1HPGDHSD17B10

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