SCHEMBL28849044

SCHEMBL28849044

CCOC(=O)c1c(O)c2ccccc2n(CC2CC(=O)N(c3ccccc3)C2)c1=O

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.64
RECQL P46063 1/20 0.59
LMNA P02545 2/20 0.57
ALDH1A1 P00352 7/20 0.56
HTT P42858 4/20 0.55
USP2 O75604 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HSD17B10 Q99714 1/20 0.48
GSK3B P49841 1/20 0.47
HPGD P15428 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NPC1 O15118 1/20 0.44

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
SCHEMBL29950182 1.00 KDM4E (0.64) KDM4ERECQLLMNAALDH1A1HTT
SCHEMBL11389635 0.85 KDM4E (0.76) KDM4ERECQLLMNAALDH1A1HTT
SCHEMBL29950091 0.82 KDM4E (0.62) KDM4ERECQLLMNAALDH1A1HTT
SCHEMBL28849142 0.82 KDM4E (0.62) KDM4ERECQLLMNAALDH1A1HTT
SCHEMBL29950257 0.82 KDM4E (0.62) KDM4ERECQLLMNAALDH1A1HTT
SCHEMBL29950469 0.81 EGLN1 (0.59) KDM4ELMNAHTTMEN1KMT2A
SCHEMBL29949910 0.81 KDM4E (0.64) KDM4ERECQLLMNAALDH1A1HTT
SCHEMBL28849083 0.81 KDM4E (0.64) KDM4ERECQLLMNAALDH1A1HTT
SCHEMBL2383886 0.79 KDM4E (1.00) KDM4ERECQLLMNAALDH1A1HTT
SCHEMBL1522936 0.75 KDM4E (0.81) KDM4ERECQLLMNAALDH1A1HTT

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
CN-108069952-B Quinolinone compound and application thereof in medicines 广东东阳光药业有限公司 2022-09-27 CN disclosed