SCHEMBL313600

SCHEMBL313600

CCOC(=O)Nc1cc(O)ccc1-c1cc(=O)c2nc(O)ncc2o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.41
KDM4E B2RXH2 4/20 0.37
HPGD P15428 3/20 0.37
HSD17B10 Q99714 3/20 0.37
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
ELANE P08246 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GLA P06280 1/20 0.35
POLB P06746 1/20 0.35
MIF P14174 2/20 0.35
PFKFB3 Q16875 1/20 0.35
MAOA P21397 1/20 0.35
AKR1B1 P15121 1/20 0.35
POLH Q9Y253 1/20 0.35
AGPAT2 O15120 1/20 0.35
XDH P47989 1/20 0.35

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
SCHEMBL311757 0.86 MAOB (0.39) MAOBKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL312259 0.86 MAOB (0.40) MAOBKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL312716 0.86 MAOB (0.43) MAOBKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL312452 0.85 MAOB (0.39) MAOBKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL312485 0.85 HPGD (0.39) MAOBKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL311135 0.83 MAOB (0.44) MAOBKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL312670 0.83 HPGD (0.42) MAOBKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL312179 0.83 MAOB (0.39) MAOBKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL311620 0.82 AKR1B1 (0.43) MAOBKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL312054 0.81 MAOB (0.39) MAOBKDM4EHPGDHSD17B10ALDH1A1

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
US-8093273-B2 Flavanoids and isoflavanoids for the prevention and treatment of cardiovascular diseases RESVERLOGIX CORP. (CA) 2012-01-10 US disclosed
EP-2332527-A2 Flavanoids and Isoflavanoids for the prevention and treatment of cardiovascular diseases RESVERLOGIX CORP. (CA) 2011-06-15 EP disclosed