SCHEMBL8076366

SCHEMBL8076366

C=CCOc1c(OCC=C(C)C)c2ccc(NCc3ccccc3)cc2n(CCCCCCCC)c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.42
PSEN1 P49768 8/20 0.38
PSEN2 P49810 8/20 0.38
APH1B Q8WW43 8/20 0.38
NCSTN Q92542 8/20 0.38
APH1A Q96BI3 8/20 0.38
PSENEN Q9NZ42 8/20 0.38
KDM4E B2RXH2 4/20 0.37
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 3/20 0.37
TP53 P04637 2/20 0.37
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
FFAR1 O14842 1/20 0.35

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
SCHEMBL8079821 0.94 ADRA2A (0.43) ADRA2APSEN1PSEN2APH1BNCSTN
SCHEMBL8004450 0.94 ADRA2A (0.43) ADRA2APSEN1PSEN2APH1BNCSTN
SCHEMBL8004334 0.93 ADRA2A (0.39) ADRA2APSEN1PSEN2APH1BNCSTN
SCHEMBL8004338 0.93 ADRA2A (0.39) ADRA2APSEN1PSEN2APH1BNCSTN
SCHEMBL7997560 0.92 ADRA2A (0.45) ADRA2APSEN1PSEN2APH1BNCSTN
SCHEMBL7998854 0.92 ADRA2A (0.45) ADRA2APSEN1PSEN2APH1BNCSTN
SCHEMBL8001552 0.90 ADRA2A (0.45) ADRA2APSEN1PSEN2APH1BNCSTN
SCHEMBL8002082 0.90 ADRA2A (0.41) ADRA2APSEN1PSEN2APH1BNCSTN
SCHEMBL8002077 0.90 ADRA2A (0.41) ADRA2APSEN1PSEN2APH1BNCSTN
SCHEMBL7989437 0.89 ADRA2A (0.44) ADRA2APSEN1PSEN2APH1BNCSTN

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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