SCHEMBL7998939

SCHEMBL7998939

C=CCOc1c(OC)c2ccc([N+](=O)[O-])cc2n(CCCCCCCC)c1=O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CNR2 P34972 4/20 0.41
CNR1 P21554 3/20 0.41
ACHE P22303 3/20 0.41
HTR1A P08908 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
TDP1 Q9NUW8 6/20 0.37
TDP2 O95551 2/20 0.37
CYP1A2 P05177 2/20 0.36
PSMD14 O00487 1/20 0.36
NPC1 O15118 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 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
SCHEMBL7997345 1.00 MAPT (0.45) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8004828 0.96 MAPT (0.41) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7988509 0.93 MAPT (0.45) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7999456 0.93 CNR1 (0.46) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8004291 0.93 MAPT (0.45) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8004227 0.93 CNR1 (0.46) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7997858 0.91 CNR1 (0.43) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8001574 0.89 CNR1 (0.49) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8004088 0.89 CNR1 (0.49) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8000831 0.89 MEN1 (0.48) 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