SCHEMBL7988415

SCHEMBL7988415

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

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.45
ACHE P22303 2/20 0.45
CNR2 P34972 2/20 0.45
MAPT P10636 4/20 0.43
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HPGD P15428 1/20 0.40
CYP1A2 P05177 1/20 0.40
PKM P14618 2/20 0.39
KCNA3 P22001 1/20 0.39
KCNA5 P22460 1/20 0.39
TDP1 Q9NUW8 3/20 0.39
F2RL3 Q96RI0 1/20 0.39

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
SCHEMBL8002157 0.96 CNR1 (0.48) CNR1ACHECNR2MAPTPOLB
SCHEMBL8005013 0.96 CNR1 (0.48) CNR1ACHECNR2MAPTPOLB
SCHEMBL8001543 0.95 CNR1 (0.45) CNR1ACHECNR2MAPTPOLB
SCHEMBL7997387 0.94 CNR1 (0.47) CNR1ACHECNR2MAPTPOLB
SCHEMBL7999038 0.91 CNR1 (0.48) CNR1ACHECNR2MAPTPOLB
SCHEMBL7997250 0.91 CNR1 (0.50) CNR1ACHECNR2MAPTPOLB
SCHEMBL7997649 0.91 CNR1 (0.50) CNR1ACHECNR2MAPTPOLB
SCHEMBL7997847 0.91 CNR1 (0.50) CNR1ACHECNR2MAPTPOLB
SCHEMBL7998924 0.90 CNR1 (0.51) CNR1ACHECNR2MAPTPOLB
SCHEMBL7997356 0.90 CNR1 (0.51) CNR1ACHECNR2MAPTPOLB

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