SCHEMBL3976353

SCHEMBL3976353

O=C(COc1ccccc1)NC(c1cc(Cl)c2cccnc2c1O)c1cccc2cccnc12.O=C(COc1ccccc1)NC(c1cc(Cl)c2cccnc2c1O)c1cccc2ncccc12.O=C(COc1ccccc1)NC(c1cc(Cl)c2cccnc2c1O)c1ccnc2ccccc12

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 20/20 0.75
ADAMTS4 O75173 2/20 0.75

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
SCHEMBL1815238 0.95 ADAMTS5 (0.83) ADAMTS5ADAMTS4
SCHEMBL1815702 0.94 ADAMTS5 (0.81) ADAMTS5ADAMTS4
SCHEMBL1815211 0.94 ADAMTS5 (0.84) ADAMTS5ADAMTS4
SCHEMBL1813659 0.86 ADAMTS5 (1.00) ADAMTS5ADAMTS4
SCHEMBL1813190 0.86 ADAMTS5 (1.00) ADAMTS5ADAMTS4
SCHEMBL1813188 0.86 ADAMTS5 (1.00) ADAMTS5ADAMTS4
SCHEMBL1812138 0.85 ADAMTS5 (0.87) ADAMTS5ADAMTS4
SCHEMBL1813427 0.85 ADAMTS5 (0.79) ADAMTS5ADAMTS4
SCHEMBL1813564 0.85 ADAMTS5 (0.80) ADAMTS5ADAMTS4
SCHEMBL1814823 0.84 ADAMTS5 (0.84) ADAMTS5ADAMTS4

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-2056823-A2 8-HYDROXYQUINOLINE COMPOUNDS AND METHODS THEREOF Wyeth (US) 2009-05-13 EP claimed
WO-2008024922-A2 8-HYDROXYQUINOLINE COMPOUNDS AND METHODS THEREOF WYETH (US) 2008-02-28 WO claimed
EP-2056823-A2 8-HYDROXYQUINOLINE COMPOUNDS AND METHODS THEREOF Wyeth (US) 2009-05-13 EP disclosed
WO-2008024922-A2 8-HYDROXYQUINOLINE COMPOUNDS AND METHODS THEREOF WYETH (US) 2008-02-28 WO disclosed