SCHEMBL8309183

SCHEMBL8309183

C1=COC1.C=CCOc1cc(OCC2=COC(C)(C)O2)cc2oc(-c3ccc(OC)cc3)cc(=O)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.51
MAOA P21397 6/20 0.51
ABCB1 P08183 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
PPARG P37231 2/20 0.43
ALDH1A1 P00352 4/20 0.42
CYP3A4 P08684 2/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP19A1 P11511 1/20 0.42
PLG P00747 1/20 0.42
ELANE P08246 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
KCNA5 P22460 2/20 0.41
KCNH2 Q12809 2/20 0.41
NPC1 O15118 2/20 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
SCHEMBL8309111 0.92 ABCB1 (0.57) MAOBMAOAABCB1L3MBTL1ALDH1A1
SCHEMBL8305997 0.87 MAOB (0.64) MAOBMAOAABCB1L3MBTL1PPARG
SCHEMBL8309181 0.87 MAOB (0.51) MAOBMAOAABCB1L3MBTL1PPARG
SCHEMBL8304396 0.87 MAOB (0.59) MAOBMAOAABCB1ALDH1A1CYP3A4
SCHEMBL8305537 0.86 MAOB (0.51) MAOBMAOAABCB1L3MBTL1PPARG
SCHEMBL8309109 0.85 MAOB (0.54) MAOBMAOAABCB1L3MBTL1PPARG
SCHEMBL8429317 0.84 HPGD (0.56) ABCB1L3MBTL1ALDH1A1CYP3A4MAPT
SCHEMBL8310187 0.83 ABCB1 (0.56) MAOBMAOAABCB1L3MBTL1ALDH1A1
SCHEMBL8304325 0.81 CYP1B1 (0.54) MAOBMAOAPPARGALDH1A1CYP3A4
SCHEMBL8309007 0.80 MAOB (0.53) MAOBMAOAABCB1PPARGALDH1A1

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