SCHEMBL29190318

SCHEMBL29190318

O=C1C=Cc2cccc(=O)n21

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 18/20 0.38
FAAH O00519 6/20 0.38
TLR9 Q9NR96 1/20 0.36
HSP90AA1 P07900 3/20 0.32
ALDH1A1 P00352 2/20 0.31
HTT P42858 2/20 0.31
ATM Q13315 2/20 0.31
PKM P14618 1/20 0.31
GSK3A P49840 2/20 0.31
GSK3B P49841 2/20 0.31
HPGD P15428 1/20 0.31
XBP1 P17861 1/20 0.31
ALOX12 P18054 1/20 0.31
RUNX1 Q01196 1/20 0.31
CBFB Q13951 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
SCHEMBL426650 0.63
SCHEMBL23937960 0.62 FAAH (0.30) MGLLFAAH
SCHEMBL6991905 0.61 NOTUM (0.46) MGLLFAAHTLR9HSP90AA1ALDH1A1
SCHEMBL1838889 0.55 MGLL (1.00) MGLLFAAHHSP90AA1ALDH1A1HTT
SCHEMBL94730 0.55 MGLL (1.00) MGLLFAAHHSP90AA1ALDH1A1HTT
SCHEMBL13575342 0.55 GSK3B (0.45) MGLLALDH1A1HTTATMGSK3A
SCHEMBL3697751 0.55
SCHEMBL349418 0.54 MGLL (0.50) MGLLFAAHTLR9HSP90AA1ALDH1A1
SCHEMBL375596 0.54 ADORA3 (0.47) HSP90AA1ALDH1A1HPGD
SCHEMBL3778737 0.54 MGLL (0.61) MGLLFAAHTLR9HSP90AA1ALDH1A1

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
CN-117567463-A Synthesis method of indolizine-3, 5-dione 菏泽学院 2024-02-20 CN disclosed
CN-117567463-A Synthesis method of indolizine-3, 5-dione 菏泽学院 2024-02-20 CN disclosed
CN-117567463-A Synthesis method of indolizine-3, 5-dione 菏泽学院 2024-02-20 CN disclosed