SCHEMBL8005702

SCHEMBL8005702

C=CCOc1c(OCC=C(C)C)c2ccc(N)cc2n(CCCCCCCC)c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.37
MAPK1 P28482 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MAPT P10636 2/20 0.36
HTT P42858 2/20 0.36
MEN1 O00255 2/20 0.36
POLB P06746 2/20 0.36
KMT2A Q03164 2/20 0.36
USP2 O75604 1/20 0.36
PSEN1 P49768 8/20 0.35
PSEN2 P49810 8/20 0.35
APH1B Q8WW43 8/20 0.35
NCSTN Q92542 8/20 0.35
APH1A Q96BI3 8/20 0.35
PSENEN Q9NZ42 8/20 0.35
TYMS P04818 1/20 0.35
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 2/20 0.33
CNR2 P34972 2/20 0.33
RORA P35398 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
SCHEMBL7990382 1.00 KDM4E (0.37) KDM4EMAPK1NPSR1MAPTHTT
SCHEMBL8001085 0.96 KDM4E (0.35) KDM4EMAPK1NPSR1MAPTMEN1
SCHEMBL7989272 0.92 MAPT (0.39) KDM4EMAPK1NPSR1MAPTHTT
SCHEMBL8004782 0.92 MAPT (0.39) KDM4EMAPK1NPSR1MAPTHTT
SCHEMBL7988851 0.92 MAPT (0.39) KDM4EMAPK1NPSR1MAPTHTT
SCHEMBL7999772 0.92 MAPT (0.39) KDM4EMAPK1NPSR1MAPTHTT
SCHEMBL8001047 0.92 MAPT (0.39) KDM4EMAPK1NPSR1MAPTHTT
SCHEMBL7999392 0.92 MAPT (0.39) KDM4EMAPK1NPSR1MAPTHTT
SCHEMBL7989253 0.92 TDP1 (0.39) KDM4EMAPK1NPSR1MAPTMEN1
SCHEMBL8001792 0.92 TDP1 (0.39) KDM4EMAPK1NPSR1MAPTMEN1

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
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
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