SCHEMBL30003545

SCHEMBL30003545

O=C1C(O)=CC(=O)c2c(O)c(O)cc(O)c21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.50
KDM4E B2RXH2 9/20 0.50
KMT2A Q03164 7/20 0.50
MEN1 O00255 6/20 0.50
RECQL P46063 6/20 0.50
ALDH1A1 P00352 6/20 0.50
HPGD P15428 5/20 0.50
MAPK1 P28482 5/20 0.50
CYP3A4 P08684 4/20 0.50
ALOX15 P16050 3/20 0.50
BRCA1 P38398 3/20 0.50
HSD17B10 Q99714 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MAOA P21397 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
ALOX12 P18054 2/20 0.50
TTR P02766 1/20 0.50
CYP1A1 P04798 1/20 0.50
HSPD1 P10809 1/20 0.50
ACHE P22303 1/20 0.50

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
SCHEMBL5816866 1.00 MAPT (0.50) MAPTKDM4EKMT2AMEN1RECQL
SCHEMBL5820321 0.92 KDM4E (0.50) MAPTKDM4EKMT2AMEN1RECQL
SCHEMBL19303804 0.87 MAPT (0.41) MAPTKDM4EKMT2AMEN1RECQL
SCHEMBL23271692 0.80 MAPT (0.63) MAPTKDM4EKMT2AMEN1RECQL
SCHEMBL30003519 0.80 MAPT (0.63) MAPTKDM4EKMT2AMEN1RECQL
SCHEMBL30004100 0.80 MEN1 (0.47) MAPTKDM4EKMT2AMEN1RECQL
SCHEMBL23271729 0.80 MEN1 (0.47) MAPTKDM4EKMT2AMEN1RECQL
SCHEMBL23271666 0.80 AURKA (0.47) MAPTKDM4EKMT2AMEN1RECQL
SCHEMBL30002972 0.80 AURKA (0.47) MAPTKDM4EKMT2AMEN1RECQL
SCHEMBL10494235 0.80 XIAP (0.44) MAPTKDM4EKMT2AMEN1RECQL

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-110891980-B Radical polymerization control agent and radical polymerization control method 川崎化成工业株式会社 2022-09-30 CN disclosed