SCHEMBL7988892

SCHEMBL7988892

CCCCOc1c(OC=O)c(=O)n(C)c2cc([N+](=O)[O-])ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.43
ACHE P22303 2/20 0.43
CNR2 P34972 2/20 0.43
MAPT P10636 4/20 0.41
MAPK1 P28482 2/20 0.41
HTT P42858 2/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PKM P14618 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CYP1A2 P05177 1/20 0.38
NCOA1 Q15788 1/20 0.37
NCOA3 Q9Y6Q9 1/20 0.37
TDP1 Q9NUW8 2/20 0.37
LMNA P02545 1/20 0.37
F2RL3 Q96RI0 1/20 0.37
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL8001358 0.96 CNR1 (0.46) CNR1ACHECNR2MAPTMAPK1
SCHEMBL7997387 0.91 CNR1 (0.47) CNR1ACHECNR2MAPTMAPK1
SCHEMBL8001543 0.90 CNR1 (0.45) CNR1ACHECNR2MAPTMAPK1
SCHEMBL7989002 0.90 CNR1 (0.41) CNR1ACHECNR2MAPTMAPK1
SCHEMBL8001661 0.88 CYP1A2 (0.44) CNR1ACHECNR2MAPTMAPK1
SCHEMBL7997250 0.88 CNR1 (0.50) CNR1ACHECNR2MAPTMAPK1
SCHEMBL7997847 0.88 CNR1 (0.50) CNR1ACHECNR2MAPTMAPK1
SCHEMBL7997649 0.88 CNR1 (0.50) CNR1ACHECNR2MAPTMAPK1
SCHEMBL8002267 0.88 MAPT (0.46) CNR1ACHECNR2MAPTMAPK1
SCHEMBL8005117 0.88 MAPT (0.46) CNR1ACHECNR2MAPTMAPK1

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