SCHEMBL8306319

SCHEMBL8306319

COCC(C)c1ccc(-c2cc(=O)c3c(O)cc(OC[C@@H](O)CO)cc3o2)cc1O

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.52
MAOB P27338 3/20 0.50
MAOA P21397 1/20 0.50
EGFR P00533 1/20 0.50
RET P07949 1/20 0.50
KDR P35968 1/20 0.50
QPCT Q16769 1/20 0.49
IP6K2 Q9UHH9 2/20 0.48
FLT3 P36888 1/20 0.48
MKNK2 Q9HBH9 1/20 0.48
CYP19A1 P11511 1/20 0.48
KDM1A O60341 1/20 0.48
CYP1A1 P04798 1/20 0.48
CYP1A2 P05177 1/20 0.48
ABCC1 P33527 1/20 0.48
XDH P47989 1/20 0.48
CYP1B1 Q16678 1/20 0.48
IPMK Q8NFU5 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48

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
SCHEMBL8309077 1.00 PLG (0.52) PLGMAOBMAOAEGFRRET
SCHEMBL8308746 1.00 PLG (0.52) PLGMAOBMAOAEGFRRET
SCHEMBL8309778 0.92 POLH (0.50) MAOBMAOAIP6K2KDM1ACYP1A1
SCHEMBL8309435 0.89 PLG (0.48) PLGMAOBMAOAEGFRRET
SCHEMBL8429280 0.88 XDH (0.51) PLGMAOBMAOAEGFRRET
SCHEMBL8305421 0.88 MAOB (0.58) PLGMAOBMAOAEGFRRET
SCHEMBL8306760 0.86 CYP1B1 (0.64) PLGMAOBMAOAQPCTIP6K2
SCHEMBL4575622 0.85 CYP1B1 (0.68) PLGMAOBMAOAKDRIP6K2
SCHEMBL8304881 0.85 CYP1B1 (0.68) PLGMAOBMAOAKDRIP6K2
SCHEMBL4575616 0.85 CYP1B1 (0.68) PLGMAOBMAOAKDRIP6K2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0709383-B1 Diosmetin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1999-12-15 EP claimed
EP-0709383-A1 Diosmetin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-05-01 EP claimed
EP-0709383-B1 Diosmetin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1999-12-15 EP disclosed
EP-0709383-A1 Diosmetin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-05-01 EP disclosed