SCHEMBL9389416

SCHEMBL9389416

O=c1[nH]c2c(Cl)cccc2c(=O)cc1O

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DAO P14920 8/20 0.66
KDM4E B2RXH2 2/20 0.49
DYRK1A Q13627 2/20 0.47
TDP1 Q9NUW8 1/20 0.46
DDO Q99489 4/20 0.45
TP53 P04637 1/20 0.43
PLA2G7 Q13093 1/20 0.43

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
SCHEMBL9393346 0.80 DAO (0.49) DAOKDM4EDYRK1ATDP1DDO
SCHEMBL9388997 0.80 DAO (0.66) DAOKDM4ETDP1DDOPLA2G7
SCHEMBL9389395 0.80 KDM4E (0.46) DAOKDM4ETDP1DDOPLA2G7
SCHEMBL8583717 0.80 DAO (0.66) DAOKDM4ETDP1DDOPLA2G7
SCHEMBL16767858 0.79 DAO (1.00) DAODDO
SCHEMBL9390027 0.78 DAO (0.68) DAOKDM4ETDP1DDOPLA2G7
SCHEMBL9389023 0.76 DAO (0.45) DAOKDM4ETDP1DDOTP53
SCHEMBL9389330 0.76 KDM4E (0.43) DAOKDM4ETDP1DDOPLA2G7
SCHEMBL9389819 0.76 KIF11 (0.47) DAOKDM4ETDP1DDOPLA2G7
SCHEMBL2269012 0.76 KDM4E (0.64) DAOKDM4EDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1994007500-A1 2,5-DIHYDRO-2,5-DIOXO-1H-AZEPINES AND 2,5-DIHYDRO-2-OXO-1H-AZEPINES AND THE USE THEREOF AS EXCITATORY AMINO ACID AND GLYCINE RECEPTOR ANTAGONISTS WEBER ECKARD (US) 1994-04-14 WO disclosed