SCHEMBL7306849

SCHEMBL7306849

COc1ccc(-c2cc(=O)c3c(O)cc(OCc4ccccc4)cc3o2)cc1O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.74
ABCB1 P08183 2/20 0.74
CYP1B1 Q16678 5/20 0.71
CYP1A1 P04798 4/20 0.71
CYP1A2 P05177 2/20 0.71
ABCC1 P33527 2/20 0.71
KDM1A O60341 2/20 0.71
IP6K2 Q9UHH9 2/20 0.71
XDH P47989 1/20 0.71
IPMK Q8NFU5 1/20 0.71
HDAC6 Q9UBN7 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.62
NPC1 O15118 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2C9 P11712 1/20 0.61
TSHR P16473 1/20 0.61
CYP2C19 P33261 1/20 0.61
ABCG2 Q9UNQ0 1/20 0.61
KDR P35968 2/20 0.61
EGFR P00533 1/20 0.61

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
SCHEMBL1976256 0.89 MAPT (0.67) MAPTABCB1CYP1B1CYP1A1CYP1A2
SCHEMBL8306488 0.87 MAPT (0.64) MAPTABCB1CYP1B1CYP1A1CYP1A2
SCHEMBL5792042 0.86 MAPT (0.91) MAPTABCB1CYP1B1CYP1A1CYP1A2
SCHEMBL974548 0.85 MAPT (1.00) MAPTABCB1CYP1B1CYP1A1CYP1A2
SCHEMBL26117114 0.85 CYP1B1 (0.86) MAPTABCB1CYP1B1CYP1A1CYP1A2
SCHEMBL30376285 0.85 MAPT (1.00) MAPTABCB1CYP1B1CYP1A1CYP1A2
SCHEMBL7315053 0.85 MAPT (0.62) MAPTABCB1CYP1B1CYP1A1CYP1A2
SCHEMBL8064295 0.85 L3MBTL1 (0.71) MAPTABCB1CYP1B1CYP1A1CYP1A2
SCHEMBL8066758 0.84 L3MBTL1 (0.72) MAPTABCB1CYP1B1CYP1A1CYP1A2
SCHEMBL14048682 0.83 MAPT (0.78) MAPTABCB1CYP1B1CYP1A1CYP1A2

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-0832886-B1 Flavon derivatives, process for their preparation, and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-11-13 EP disclosed
US-5889003-A PHOSPHODIESTERASE INHIBITOR ADIR ET COMPAGNIE (FR) 1999-03-30 US disclosed
EP-0832886-A1 Flavon derivatives, process for their preparation, and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-04-01 EP disclosed
US-5629339-A CHRONIC VENOUS INSUFFICIENCY ADIR ET COMPAGNIE (FR) 1997-05-13 US disclosed