SCHEMBL8001377

SCHEMBL8001377

CCCCCCn1c(=O)c(OCC(C)CCC)c(OC)c2ccc(NC(=O)c3ccccc3)cc21

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CNR2 P34972 3/20 0.41
CNR1 P21554 1/20 0.40
TYMS P04818 1/20 0.39
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 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
SCHEMBL8000218 0.94 MEN1 (0.42) MAPTMEN1KMT2ATYMS
SCHEMBL7998961 0.94 NR1H4 (0.42) MAPTMEN1KMT2APSEN1PSEN2
SCHEMBL8001066 0.94 NR1H4 (0.42) MAPTMEN1KMT2ACNR2TYMS
SCHEMBL8080800 0.91 MEN1 (0.48) MEN1KMT2ATYMS
SCHEMBL7997373 0.89 MEN1 (0.38) MAPTMEN1KMT2ACNR2TYMS
SCHEMBL7997374 0.89 MEN1 (0.38) MAPTMEN1KMT2ACNR2TYMS
SCHEMBL8074612 0.89 MAPT (0.48) MAPTMEN1KMT2ACNR2
SCHEMBL8002274 0.85 ADRA2A (0.43) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL7997488 0.85 MAPT (0.45) MAPTMEN1KMT2ACNR2CNR1
SCHEMBL7998711 0.85 MEN1 (0.35) MAPTMEN1KMT2ACNR2TYMS

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