SCHEMBL6579786

SCHEMBL6579786

C/C=C\n1c(=O)c(OCCCCCCCC)c(O)c2ccc(CCCC)cc21

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.39
RORA P35398 1/20 0.36
RORC P51449 1/20 0.36
RORB Q92753 1/20 0.36
SERPINE1 P05121 1/20 0.35
CNR1 P21554 3/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 1/20 0.34
KAT8 Q9H7Z6 2/20 0.34
THRA P10827 2/20 0.34
THRB P10828 2/20 0.34
PPARA Q07869 1/20 0.34
PLA2G4A P47712 1/20 0.33
LMNA P02545 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
SCHEMBL6579794 1.00 CNR2 (0.39) CNR2RORARORCRORBSERPINE1
SCHEMBL6578979 0.88 CNR2 (0.38) CNR2CNR1KDM4EALDH1A1HPGD
SCHEMBL6578986 0.88 CNR2 (0.38) CNR2CNR1KDM4EALDH1A1HPGD
SCHEMBL6577074 0.87 ALDH2 (0.40) CNR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6581339 0.87 CNR2 (0.40) CNR2RORARORCRORBKDM4E
SCHEMBL6581346 0.87 CNR2 (0.40) CNR2RORARORCRORBKDM4E
SCHEMBL6577064 0.87 ALDH2 (0.40) CNR2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6579027 0.82 LMNA (0.40) CNR2RORARORCRORBCNR1
SCHEMBL6582135 0.78 CNR1 (0.39) CNR2CNR1KDM4EALDH1A1LMNA
SCHEMBL6582132 0.78 CNR1 (0.39) CNR2CNR1KDM4EALDH1A1LMNA

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 3 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