SCHEMBL8001960

SCHEMBL8001960

CCCCCCn1c(=O)c(OC/C=C(\C)CCC=C(C)C)c(O)c2ccc(N)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.41
CYP3A4 P08684 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
CYP2E1 P05181 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
CYP2B6 P20813 1/20 0.41
CYP3A5 P20815 1/20 0.41
CYP2C19 P33261 1/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALOX15 P16050 5/20 0.39
TYMS P04818 1/20 0.38

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
SCHEMBL7989038 1.00 BACE1 (0.41) BACE1KDM4EALDH1A1CYP3A4TDP1
SCHEMBL7989045 1.00 BACE1 (0.41) BACE1KDM4EALDH1A1CYP3A4TDP1
SCHEMBL8001963 1.00 BACE1 (0.41) BACE1KDM4EALDH1A1CYP3A4TDP1
SCHEMBL8004451 0.96 TDP1 (0.42) BACE1KDM4EALDH1A1CYP3A4TDP1
SCHEMBL8004455 0.96 TDP1 (0.42) BACE1KDM4EALDH1A1CYP3A4TDP1
SCHEMBL8001274 0.93 TDP1 (0.41) BACE1KDM4EALDH1A1CYP3A4TDP1
SCHEMBL8001270 0.93 TDP1 (0.41) BACE1KDM4EALDH1A1CYP3A4TDP1
SCHEMBL8001034 0.93 TDP1 (0.41) BACE1KDM4EALDH1A1CYP3A4TDP1
SCHEMBL8001027 0.93 TDP1 (0.41) BACE1KDM4EALDH1A1CYP3A4TDP1
SCHEMBL8001549 0.93 TDP1 (0.42) BACE1KDM4EALDH1A1CYP3A4TDP1

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