SCHEMBL7997009

SCHEMBL7997009

CCCCOc1c(OCC=C(C)C)c2ccc([N+](=O)[O-])cc2n(CCCC)c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.39
ACHE P22303 2/20 0.39
CNR2 P34972 2/20 0.39
MAPT P10636 5/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
PKM P14618 1/20 0.36
CYP1A2 P05177 2/20 0.36
ALK Q9UM73 1/20 0.36
POLB P06746 2/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 4/20 0.35
PSMD14 O00487 1/20 0.35
NPC1 O15118 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL7988463 0.96 CNR1 (0.42) CNR1ACHECNR2MAPTMEN1
SCHEMBL8004552 0.96 MEN1 (0.44) CNR1ACHECNR2MAPTMEN1
SCHEMBL7997603 0.96 CNR1 (0.42) CNR1ACHECNR2MAPTMEN1
SCHEMBL7997052 0.96 MEN1 (0.44) CNR1ACHECNR2MAPTMEN1
SCHEMBL7988395 0.94 CNR1 (0.44) CNR1ACHECNR2MAPTMEN1
SCHEMBL8000897 0.94 CNR1 (0.44) CNR1ACHECNR2MAPTMEN1
SCHEMBL7998901 0.94 CNR1 (0.44) CNR1ACHECNR2MAPTMEN1
SCHEMBL8001177 0.94 CNR1 (0.44) CNR1ACHECNR2MAPTMEN1
SCHEMBL8000565 0.93 CYP1A2 (0.41) CNR1ACHECNR2MAPTMEN1
SCHEMBL8001878 0.93 MAPT (0.39) CNR1ACHECNR2MAPTMEN1

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