SCHEMBL7998876

SCHEMBL7998876

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

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
TDP1 Q9NUW8 10/20 0.37
TDP2 O95551 3/20 0.37
CNR2 P34972 3/20 0.37
CNR1 P21554 2/20 0.37
ACHE P22303 2/20 0.37
CYP1A2 P05177 2/20 0.36
CYP1A1 P04798 1/20 0.36
ABCB1 P08183 1/20 0.36
CYP1B1 Q16678 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
SCHEMBL7999424 0.96 MAPT (0.44) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL8004122 0.96 MAPT (0.44) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL8001190 0.93 MAPT (0.38) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL7997009 0.93 CNR1 (0.39) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL8001983 0.92 BACE1 (0.42) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL8001989 0.92 BACE1 (0.42) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL7988463 0.91 CNR1 (0.42) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL8000514 0.91 MAPT (0.38) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL7997603 0.91 CNR1 (0.42) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL8001878 0.91 MAPT (0.39) MAPTMEN1KMT2AKDM4EALDH1A1

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