SCHEMBL6581346

SCHEMBL6581346

CC=Cn1c(=O)c(OCCCCCCCC)c(O)c2ccc(C)cc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.40
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HTT P42858 1/20 0.35
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GSK3B P49841 2/20 0.33
PGR P06401 1/20 0.33
RORA P35398 1/20 0.33
RORC P51449 1/20 0.33
RORB Q92753 1/20 0.33
GPR84 Q9NQS5 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
SCHEMBL6581339 1.00 CNR2 (0.40) CNR2MEN1KMT2AALDH1A1KDM4E
SCHEMBL6578979 0.90 CNR2 (0.38) CNR2MEN1KMT2AALDH1A1KDM4E
SCHEMBL6578986 0.90 CNR2 (0.38) CNR2MEN1KMT2AALDH1A1KDM4E
SCHEMBL6577074 0.89 ALDH2 (0.40) CNR2MEN1KMT2AALDH1A1KDM4E
SCHEMBL6577064 0.89 ALDH2 (0.40) CNR2MEN1KMT2AALDH1A1KDM4E
SCHEMBL6579786 0.87 CNR2 (0.39) CNR2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6579794 0.87 CNR2 (0.39) CNR2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6581007 0.83 ALDH1A1 (0.46) CNR2MEN1KMT2AALDH1A1KDM4E
SCHEMBL6582135 0.80 CNR1 (0.39) CNR2MEN1KMT2AALDH1A1KDM4E
SCHEMBL6582132 0.80 CNR1 (0.39) CNR2MEN1KMT2AALDH1A1KDM4E

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