SCHEMBL8307532

SCHEMBL8307532

CCCc1c(-c2cc(=O)c3c(OCC4=COC(C)(C)O4)cc(OCC4=COC(C)(C)O4)cc3o2)ccc(OC)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
POLH Q9Y253 1/20 0.38
BRD4 O60885 1/20 0.38
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
ABCB1 P08183 1/20 0.37
KDM4E B2RXH2 4/20 0.37
POLB P06746 3/20 0.37
MAPT P10636 2/20 0.37
PPARG P37231 1/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37

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 0.98 BRD4 (0.40) POLHBRD4MAOAMAOBABCB1
SCHEMBL8306914 0.94 CYP1B1 (0.43) MAOAMAOBABCB1POLBMAPT
SCHEMBL8307688 0.91 MAPT (0.35) POLHBRD4MAOAMAOBKDM4E
SCHEMBL8308992 0.91 MAOB (0.39) L3MBTL1POLHBRD4MAOAMAOB
SCHEMBL8309735 0.90 KDM4E (0.39) POLHABCB1KDM4EPOLBMAPT
SCHEMBL8306597 0.89 ABCB1 (0.42) L3MBTL1BRD4MAOAMAOBABCB1
SCHEMBL8310185 0.88 MAOB (0.41) POLHBRD4MAOAMAOBABCB1
SCHEMBL8306988 0.85 CYP1B1 (0.42) MAOAMAOBABCB1POLBMAPT
SCHEMBL8431005 0.84 HPGD (0.50) BRD4KDM4EPOLBMAPTALDH1A1
SCHEMBL8429193 0.84 POLB (0.48) KDM4EPOLBMAPTPPARGALDH1A1

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