SCHEMBL7989154

SCHEMBL7989154

CCCCn1c(=O)c(OC(C)C)c(OC)c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 11/20 0.40
CYP1A2 P05177 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TDP2 O95551 3/20 0.38
CNR1 P21554 2/20 0.38
ACHE P22303 2/20 0.38
CNR2 P34972 2/20 0.38
RORA P35398 1/20 0.36
RORC P51449 1/20 0.36
RORB Q92753 1/20 0.36

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
SCHEMBL8001815 0.96 MAPT (0.47) MEN1MAPTKMT2ATDP1CYP1A2
SCHEMBL8001037 0.96 MAPT (0.47) MEN1MAPTKMT2ATDP1CYP1A2
SCHEMBL8001706 0.91 MEN1 (0.46) MEN1MAPTKMT2ATDP1CYP1A2
SCHEMBL7997746 0.91 CNR1 (0.41) MEN1MAPTKMT2ATDP1CYP1A2
SCHEMBL8001281 0.89 CYP1A2 (0.48) MEN1MAPTKMT2ATDP1CYP1A2
SCHEMBL8001185 0.89 CNR1 (0.45) MEN1MAPTKMT2ACYP1A2KDM4E
SCHEMBL7987951 0.88 MEN1 (0.42) MEN1MAPTKMT2ATDP1CYP1A2
SCHEMBL7997905 0.87 CNR1 (0.43) MEN1MAPTKMT2ATDP1CYP1A2
SCHEMBL7998763 0.87 MAPT (0.52) MEN1MAPTKMT2ATDP1CYP1A2
SCHEMBL8004025 0.87 MAPT (0.52) MEN1MAPTKMT2ATDP1CYP1A2

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