SCHEMBL6578992

SCHEMBL6578992

CCCCCCCCn1c(=O)c(OC)c(O)c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
CNR2 P34972 5/20 0.47
CNR1 P21554 2/20 0.47
ACHE P22303 2/20 0.47
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.43
HTT P42858 2/20 0.43
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.41
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL7998971 0.92 MAPT (0.49) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7989452 0.92 MAPT (0.49) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7977928 0.91 CNR2 (0.52) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8004065 0.87 KDM4E (0.44) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL6582097 0.86 CNR2 (0.47) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7997703 0.85 MAPT (0.49) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7989022 0.85 MAPT (0.49) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7998763 0.84 MAPT (0.52) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8004025 0.84 MAPT (0.52) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL8001065 0.82 MAPT (0.48) MAPTMEN1KMT2ACNR2CNR1

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
EP-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed