SCHEMBL7998992

SCHEMBL7998992

CCCCCCn1c(=O)c(OC)c(OCCCC)c2ccc([N+](=O)[O-])cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
MAPT P10636 2/20 0.48
KMT2A Q03164 2/20 0.48
CNR2 P34972 3/20 0.47
CNR1 P21554 2/20 0.47
ACHE P22303 2/20 0.47
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 4/20 0.40
TDP2 O95551 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP19A1 P11511 2/20 0.39
PSEN1 P49768 2/20 0.39
PSEN2 P49810 2/20 0.39
APH1B Q8WW43 2/20 0.39
NCSTN Q92542 2/20 0.39
APH1A Q96BI3 2/20 0.39
PSENEN Q9NZ42 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 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
SCHEMBL7997053 1.00 MEN1 (0.48) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL7988675 0.98 CNR1 (0.49) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL8004201 0.98 CNR1 (0.49) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL8004567 0.96 MEN1 (0.48) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL8000831 0.96 MEN1 (0.48) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL7988387 0.96 CNR1 (0.47) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL7998843 0.96 CNR1 (0.43) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL7988981 0.95 MAPT (0.51) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL8004382 0.95 MAPT (0.51) MEN1MAPTKMT2ACNR2CNR1
SCHEMBL7997591 0.94 CNR1 (0.49) MEN1MAPTKMT2ACNR2CNR1

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