SCHEMBL7998727

SCHEMBL7998727

CCCCCCn1c(=O)c(OC(C)=O)c(OC)c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
CNR2 P34972 6/20 0.40
CNR1 P21554 3/20 0.40
ACHE P22303 2/20 0.40
KDM4E B2RXH2 4/20 0.38
MAPK1 P28482 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MGLL Q99685 1/20 0.38
LMNA P02545 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.37
CYP1A2 P05177 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37

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
SCHEMBL7997648 1.00 MEN1 (0.46) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL7998312 0.96 MAPT (0.41) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL8004856 0.91 MAPT (0.46) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL8001179 0.91 CNR1 (0.46) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL7999130 0.91 MAPT (0.46) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL8004355 0.91 MEN1 (0.46) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL8004131 0.91 MEN1 (0.46) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL7999860 0.91 CNR1 (0.46) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL7998763 0.91 MAPT (0.52) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL8004025 0.91 MAPT (0.52) MEN1MAPTKMT2ACNR2CNR1

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