SCHEMBL21621480

SCHEMBL21621480

CCCCC/C=C\C/C=C\CCCCCCCC(O)Oc1c(-c2ccc(O)c(O)c2)oc2cc(OC(C)C)cc(O)c2c1=O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLH Q9Y253 4/20 0.52
PLG P00747 1/20 0.49
NOX4 Q9NPH5 1/20 0.49
ALOX5 P09917 10/20 0.48
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
MMP1 P03956 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
APEX1 P27695 1/20 0.46
HTT P42858 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ACE2 Q9BYF1 2/20 0.45

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
SCHEMBL21621461 0.87 POLH (0.51) POLHPLGNOX4ALOX5KDM4E
SCHEMBL21621466 0.82 TOP2A (0.51) POLHPLGNOX4KDM4EMEN1
SCHEMBL21621463 0.79 POLH (0.52) POLHALOX5KDM4EMEN1MMP1
SCHEMBL23326102 0.78 PLG (0.52) POLHPLGNOX4KDM4EMEN1
SCHEMBL21621465 0.78 PLG (0.52) POLHPLGNOX4KDM4EMEN1
SCHEMBL21621468 0.76 POLH (0.64) POLHALOX5KDM4EMEN1MMP1
SCHEMBL4163481 0.75 POLH (0.65) POLHALOX5KDM4EMEN1MMP1
SCHEMBL21621478 0.74 TOP2A (0.51) POLHKDM4EMEN1MMP1POLB
SCHEMBL21621464 0.74 TOP2A (0.51) POLHKDM4EMEN1MMP1POLB
SCHEMBL28041625 0.74 POLH (0.76) POLHPLGNOX4ALOX5KDM4E

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-2020012003-A1 LIPOPHENOLIC FLAVONOID DERIVATIVES USEFUL TO REDUCE CARBONYL AND OXIDATIVE STRESSES (COS) CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2020-01-16 WO disclosed