SCHEMBL5690658

SCHEMBL5690658

COc1cc(C=C2Cc3cc(OC)c(OC)cc3C2=O)cc(OC)c1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.64
ABCB1 P08183 1/20 0.64
MAOA P21397 1/20 0.64
APP P05067 1/20 0.62
ACHE P22303 8/20 0.60
MIF P14174 2/20 0.57
CES2 O00748 1/20 0.57

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
SCHEMBL5691063 0.87 MAPT (0.63) MAOBABCB1ACHEMIF
SCHEMBL5690357 0.87 MAPT (0.63) MAOBABCB1ACHEMIF
SCHEMBL6961773 0.87 MAOB (0.74) MAOBABCB1MAOAAPPACHE
SCHEMBL6961770 0.87 MAOB (0.74) MAOBABCB1MAOAAPPACHE
SCHEMBL5690882 0.87 MAOB (0.57) MAOBABCB1MAOAAPPACHE
SCHEMBL8069049 0.86 MAOB (0.64) MAOBABCB1MAOAAPPACHE
SCHEMBL5691841 0.86 MAOB (0.64) MAOBABCB1MAOAAPPACHE
SCHEMBL5690560 0.86 MAOB (0.64) MAOBABCB1MAOAAPPACHE
SCHEMBL17439336 0.86 MAOB (0.64) MAOBABCB1MAOAAPPACHE
SCHEMBL16065599 0.86 MAOB (0.64) MAOBABCB1MAOAAPPACHE

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-1039897-B1 INADONE AND TETRALONE COMPOUNDS FOR INHIBITING CELL PROLIFERATION UNIV CALIFORNIA (US) 2006-04-12 EP disclosed
US-6162810-A Inadone and tetralone compounds for inhibiting cell proliferation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-12-19 US disclosed