SCHEMBL8004028

SCHEMBL8004028

C=CCOc1c(OCCCCCC)c2ccc(NCCCCCCCC)cc2n(C)c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.34
ADRA2A P08913 1/20 0.33
MAPT P10636 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 2/20 0.33
GAA P10253 2/20 0.33
HTT P42858 2/20 0.33
TERT O14746 1/20 0.33
AR P10275 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 3/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
ATM Q13315 1/20 0.32
GSK3B P49841 2/20 0.32
CNR2 P34972 2/20 0.31
CNR1 P21554 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL8004491 0.98 ABL1 (0.34) ABL1ADRA2AMAPTMEN1KMT2A
SCHEMBL7988502 0.92 KDM4E (0.35) ABL1ADRA2AMAPTMEN1KMT2A
SCHEMBL7998318 0.92 ABL1 (0.40) ABL1ADRA2ATERTARKDM4E
SCHEMBL7988276 0.91 ABL1 (0.39) ABL1ADRA2ATERTARKDM4E
SCHEMBL8001527 0.91 ABL1 (0.33) ABL1ADRA2AMAPTMEN1KMT2A
SCHEMBL8000560 0.90 AR (0.39) ABL1ADRA2AMEN1KMT2ALMNA
SCHEMBL8001104 0.89 AR (0.38) ABL1ADRA2AMEN1KMT2ALMNA
SCHEMBL7988945 0.89 AR (0.38) ABL1ADRA2AMEN1KMT2ALMNA
SCHEMBL7998191 0.89 ABL1 (0.33) ABL1ADRA2AMAPTLMNAGAA
SCHEMBL7997782 0.88 GSK3B (0.39) ABL1ADRA2AMAPTMEN1KMT2A

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