SCHEMBL8306325

SCHEMBL8306325

CCCc1c(O)c(CCC)c2oc(-c3ccc(C(C)COC)c(O)c3)cc(=O)c2c1O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
ELANE P08246 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
PPARG P37231 1/20 0.41

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
SCHEMBL8305238 0.89 AKT1 (0.52) AKT1
SCHEMBL8308176 0.86 AKT1 (0.52) AKT1MAPTKDM4EMEN1POLB
SCHEMBL8310363 0.79
SCHEMBL8305421 0.76 MAOB (0.58)
SCHEMBL8306760 0.76 CYP1B1 (0.64) ALDH1A1MAPTKDM4EMEN1POLB
SCHEMBL8309732 0.75
SCHEMBL8429609 0.72 ALDH1A1 (0.53) ALDH1A1MAPTKDM4EMEN1POLB
SCHEMBL27977640 0.72 AKT1 (0.54) AKT1
SCHEMBL4575458 0.71 KDM4E (0.47) ALDH1A1MAPTKDM4EMEN1POLB
SCHEMBL8431822 0.70 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EMEN1POLB

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