SCHEMBL8004380

SCHEMBL8004380

C=CCOc1c(O)c2ccc(N)cc2n(CCCCCCCC)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.43
MAPT P10636 2/20 0.43
TYMS P04818 1/20 0.43
ALDH1A1 P00352 5/20 0.41
HTT P42858 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CNR2 P34972 2/20 0.41
MAPK1 P28482 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 2/20 0.39
HPGD P15428 2/20 0.39
TP53 P04637 1/20 0.39
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
PSEN1 P49768 4/20 0.37
PSEN2 P49810 4/20 0.37
APH1B Q8WW43 4/20 0.37
NCSTN Q92542 4/20 0.37

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
SCHEMBL8001230 1.00 KDM4E (0.43) KDM4EMAPTTYMSALDH1A1HTT
SCHEMBL8001703 0.96 KDM4E (0.41) KDM4EMAPTTYMSALDH1A1HTT
SCHEMBL8004192 0.88 KDM4E (0.46) KDM4EMAPTTYMSALDH1A1HTT
SCHEMBL7999961 0.88 KDM4E (0.46) KDM4EMAPTTYMSALDH1A1HTT
SCHEMBL7998893 0.88 KDM4E (0.46) KDM4EMAPTTYMSALDH1A1HTT
SCHEMBL8001082 0.88 KDM4E (0.46) KDM4EMAPTTYMSALDH1A1HTT
SCHEMBL7998533 0.88 KDM4E (0.46) KDM4EMAPTTYMSALDH1A1HTT
SCHEMBL7997334 0.88 KDM4E (0.46) KDM4EMAPTTYMSALDH1A1HTT
SCHEMBL7988501 0.88 KDM4E (0.39) KDM4EMAPTTYMSALDH1A1HTT
SCHEMBL8000597 0.88 MEN1 (0.40) KDM4EMAPTTYMSALDH1A1HTT

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