SCHEMBL6576605

SCHEMBL6576605

CCCCCCCCCCOc1ccc2c(c1)c(O)c(OC)c(=O)n2C

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 4/20 0.47
HPGD P15428 3/20 0.47
HSD17B10 Q99714 1/20 0.47
GAA P10253 2/20 0.46
NR5A1 Q13285 1/20 0.43
CNR2 P34972 3/20 0.42
GSK3B P49841 4/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
PLA2G2A P14555 1/20 0.40

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
SCHEMBL6576521 0.91 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7974943 0.81 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7974940 0.81 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL6579398 0.81 KDM4E (0.49) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7974971 0.80 ALDH1A1 (0.45) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7978061 0.80 GSK3B (0.42) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7974954 0.79 TP53 (0.48) KDM4EALDH1A1HPGDHSD17B10GSK3B
SCHEMBL6280815 0.79 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL7974952 0.79 RORA (0.49) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL347395 0.78 LTA4H (0.50) KDM4EALDH1A1HPGDHSD17B10NR5A1

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
EP-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed