SCHEMBL8000802

SCHEMBL8000802

CCCCCCCCn1c(=O)c(OC=O)c(OC)c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CNR2 P34972 3/20 0.41
CNR1 P21554 2/20 0.41
ACHE P22303 2/20 0.41
TDP1 Q9NUW8 7/20 0.39
TDP2 O95551 2/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 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
SCHEMBL7999442 1.00 MAPT (0.47) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8001539 0.96 KMT2A (0.42) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8004025 0.94 MAPT (0.52) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7998763 0.94 MAPT (0.52) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8002267 0.91 MAPT (0.46) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8005117 0.91 MAPT (0.46) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8000892 0.91 CNR1 (0.47) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7999061 0.91 CNR1 (0.47) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8001706 0.90 MEN1 (0.46) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8000829 0.89 CNR1 (0.45) MAPTMEN1KMT2ACNR2CNR1

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