SCHEMBL7997067

SCHEMBL7997067

CCCCCCCCOc1c(O)c2ccc(NCC=C(C)C)cc2n(C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 8/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TYMS P04818 1/20 0.34

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
SCHEMBL7999736 0.89 GSK3B (0.39) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8001709 0.87 KDM4E (0.42) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8004439 0.87 KDM4E (0.42) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL6579035 0.84 NPC1 (0.46) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7998905 0.83 MEN1 (0.35) GSK3BMEN1KMT2ATYMS
SCHEMBL7998900 0.83 MEN1 (0.35) GSK3BMEN1KMT2ATYMS
SCHEMBL8004543 0.83 MEN1 (0.35) GSK3BMEN1KMT2ATYMS
SCHEMBL8001220 0.82 KDM4E (0.43) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8001338 0.82 KDM4E (0.40) GSK3BKDM4EALDH1A1HPGDHSD17B10
SCHEMBL7997246 0.81 AR (0.33) 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