SCHEMBL7998925

SCHEMBL7998925

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

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
KDM4E B2RXH2 4/20 0.48
HTT P42858 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CNR2 P34972 4/20 0.45
ALDH1A1 P00352 4/20 0.44
CNR1 P21554 1/20 0.44
ACHE P22303 1/20 0.44
CYP1A2 P05177 1/20 0.44
LMNA P02545 2/20 0.44
HPGD P15428 2/20 0.44
TP53 P04637 1/20 0.44
NOX4 Q9NPH5 1/20 0.41
SRC P12931 1/20 0.41

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
SCHEMBL7999314 1.00 MAPT (0.53) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL8001057 0.95 MAPT (0.47) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL7998971 0.88 MAPT (0.49) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL7989022 0.88 MAPT (0.49) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL7989452 0.88 MAPT (0.49) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL7997703 0.88 MAPT (0.49) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL7998038 0.87 MAPT (0.48) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL8004184 0.87 CNR2 (0.49) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL8001065 0.87 MAPT (0.48) MAPTMEN1KMT2AKDM4EHTT
SCHEMBL8001046 0.87 CNR2 (0.49) MAPTMEN1KMT2AKDM4EHTT

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