SCHEMBL8306911

SCHEMBL8306911

COC[C@H](C)c1ccc(-c2cc(=O)c3c(O)cc(OCC4=COC(C)(C)O4)cc3o2)cc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.47
EGFR P00533 1/20 0.46
RET P07949 1/20 0.46
KDR P35968 1/20 0.46
QPCT Q16769 1/20 0.45
MAOB P27338 3/20 0.44
IP6K2 Q9UHH9 2/20 0.44
FLT3 P36888 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44
CYP19A1 P11511 1/20 0.44
MAOA P21397 1/20 0.44
KDM1A O60341 1/20 0.43
CYP1A1 P04798 1/20 0.43
CYP1A2 P05177 1/20 0.43
ABCC1 P33527 1/20 0.43
XDH P47989 1/20 0.43
CYP1B1 Q16678 1/20 0.43
IPMK Q8NFU5 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
ABCB1 P08183 1/20 0.43

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
SCHEMBL8431060 1.00 PLG (0.47) PLGEGFRRETKDRQPCT
SCHEMBL8309769 1.00 PLG (0.47) PLGEGFRRETKDRQPCT
SCHEMBL8304672 0.94 POLH (0.47) PLGMAOBIP6K2MAOAKDM1A
SCHEMBL8427267 0.87 KDM4E (0.46) EGFRRETKDRCYP1A2
SCHEMBL8309732 0.85
SCHEMBL8304422 0.84 CYP1B1 (0.63) PLGKDRMAOBIP6K2FLT3
SCHEMBL8305421 0.83 MAOB (0.58) PLGEGFRRETKDRQPCT
SCHEMBL8306264 0.83 CYP1B1 (0.63) PLGMAOBIP6K2FLT3MKNK2
SCHEMBL8306760 0.82 CYP1B1 (0.64) PLGQPCTMAOBIP6K2FLT3
SCHEMBL8305061 0.82 CYP1B1 (0.59) PLGEGFRRETKDRMAOB

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 2 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 disclosed
EP-0709383-A1 Diosmetin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-05-01 EP disclosed