SCHEMBL7997308

SCHEMBL7997308

CCCCCCOc1c(OC(C)C)c(=O)n(C)c2cc([N+](=O)[O-])ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.46
ACHE P22303 2/20 0.46
CNR2 P34972 2/20 0.46
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP19A1 P11511 4/20 0.41
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
PKM P14618 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KCNH2 Q12809 1/20 0.36
NCOA1 Q15788 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
CYP1A2 P05177 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
SCHEMBL7998912 0.96 CNR1 (0.43) CNR1ACHECNR2MAPTMEN1
SCHEMBL7997356 0.92 CNR1 (0.51) CNR1ACHECNR2MAPTMEN1
SCHEMBL7998924 0.92 CNR1 (0.51) CNR1ACHECNR2MAPTMEN1
SCHEMBL7997649 0.91 CNR1 (0.50) CNR1ACHECNR2MAPTMEN1
SCHEMBL7997847 0.91 CNR1 (0.50) CNR1ACHECNR2MAPTMEN1
SCHEMBL7997250 0.91 CNR1 (0.50) CNR1ACHECNR2MAPTMEN1
SCHEMBL8001185 0.90 CNR1 (0.45) CNR1ACHECNR2MAPTMEN1
SCHEMBL8004904 0.90 CNR1 (0.47) CNR1ACHECNR2MAPTMEN1
SCHEMBL7997262 0.90 CNR1 (0.47) CNR1ACHECNR2MAPTMEN1
SCHEMBL7997512 0.89 CNR1 (0.43) 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