SCHEMBL6581368

SCHEMBL6581368

C/C=C\Oc1cc(O/C=C\C)c2c(O)c(OCCCCCCCC)c(=O)n(C)c2c1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 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
SCHEMBL6581374 1.00 ALOX5 (0.35) ALOX5KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6277841 0.82 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6277838 0.82 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7974943 0.80 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7974940 0.80 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6581314 0.71 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6280815 0.70 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6579398 0.70 KDM4E (0.49) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7976008 0.68 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6582560 0.68 ALDH1A1 (0.46) KDM4EALDH1A1HPGDHSD17B10

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