SCHEMBL5690992

SCHEMBL5690992

COc1cc2c(cc1OC)C(=O)C(=Cc1cc(F)cc(F)c1)C2

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.63
ABCB1 P08183 1/20 0.63
MAOA P21397 1/20 0.63
ACHE P22303 11/20 0.60
APP P05067 1/20 0.60

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
SCHEMBL16065599 0.84 MAOB (0.64) MAOBABCB1MAOAACHEAPP
SCHEMBL17439336 0.84 MAOB (0.64) MAOBABCB1MAOAACHEAPP
SCHEMBL5690560 0.84 MAOB (0.64) MAOBABCB1MAOAACHEAPP
SCHEMBL8069049 0.84 MAOB (0.64) MAOBABCB1MAOAACHEAPP
SCHEMBL5690658 0.84 MAOB (0.64) MAOBABCB1MAOAACHEAPP
SCHEMBL5691841 0.84 MAOB (0.64) MAOBABCB1MAOAACHEAPP
SCHEMBL5690929 0.83 MAOB (0.63) MAOBABCB1MAOAACHEAPP
SCHEMBL5691822 0.83 MAOB (0.59) MAOBABCB1MAOAACHEAPP
SCHEMBL8010257 0.82 ACHE (0.74) MAOBABCB1MAOAACHEAPP
SCHEMBL27820343 0.82 ACHE (0.74) MAOBABCB1MAOAACHEAPP

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 5 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
EP-1039897-A4 INADONE AND TETRALONE COMPOUNDS FOR INHIBITING CELL PROLIFERATION UNIV CALIFORNIA (US) 2002-10-02 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
EP-1039897-A1 INADONE AND TETRALONE COMPOUNDS FOR INHIBITING CELL PROLIFERATION The Regents of the University of California (US) 2000-10-04 EP disclosed
WO-1999025335-A1 INADONE AND TETRALONE COMPOUNDS FOR INHIBITING CELL PROLIFERATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-05-27 WO disclosed