SCHEMBL8306597

SCHEMBL8306597

CCCc1c(-c2cc(=O)c3c(OC)cc(OCC4=COC(C)(C)O4)cc3o2)ccc(OC)c1OC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.42
BRD4 O60885 1/20 0.41
MAOB P27338 4/20 0.40
MAOA P21397 3/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
ALDH1A1 P00352 2/20 0.40
ABCG2 Q9UNQ0 2/20 0.40
KDM4E B2RXH2 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
QPCT Q16769 1/20 0.38
HIF1A Q16665 1/20 0.38
EPAS1 Q99814 1/20 0.38
TP53 P04637 1/20 0.37
MDM2 Q00987 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
PPARG P37231 1/20 0.36

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
SCHEMBL8304673 0.91 BRD4 (0.40) ABCB1BRD4MAOBMAOAMEN1
SCHEMBL8307532 0.89 L3MBTL1 (0.39) ABCB1BRD4MAOBMAOAMEN1
SCHEMBL8431005 0.87 HPGD (0.50) BRD4MEN1KMT2AALDH1A1KDM4E
SCHEMBL8306914 0.86 CYP1B1 (0.43) ABCB1MAOBMAOAMEN1KMT2A
SCHEMBL8427269 0.84 EGFR (0.43) ALDH1A1KDM4EQPCTPPARG
SCHEMBL8307688 0.83 MAPT (0.35) BRD4MAOBMAOAMEN1KMT2A
SCHEMBL8310185 0.83 MAOB (0.41) ABCB1BRD4MAOBMAOAMEN1
SCHEMBL8572731 0.82 QPCT (0.38) ABCB1MAOBMEN1KMT2AALDH1A1
SCHEMBL8309092 0.82 ABCB1 (0.52) ABCB1MAOBMAOAMEN1KMT2A
SCHEMBL8309192 0.82 CYP3A4 (0.39) BRD4MAOBMAOAMEN1KMT2A

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 3 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
US-5629339-A CHRONIC VENOUS INSUFFICIENCY ADIR ET COMPAGNIE (FR) 1997-05-13 US disclosed
EP-0709383-A1 Diosmetin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-05-01 EP disclosed