SCHEMBL1813355

SCHEMBL1813355

O=C(Cc1ccccc1)NC(c1ccccc1Cl)c1cc(Cl)c2cccnc2c1O

nearest known ligand 0.79

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 18/20 0.79
ADAMTS4 O75173 1/20 0.79
TP53 P04637 1/20 0.65
POLB P06746 1/20 0.65
MEN1 O00255 1/20 0.61
ALDH1A1 P00352 1/20 0.61
HSP90AA1 P07900 1/20 0.61
RAB9A P51151 1/20 0.61
KMT2A Q03164 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
SCHEMBL1814541 0.91 ADAMTS5 (0.78) ADAMTS5ADAMTS4MEN1HSP90AA1RAB9A
SCHEMBL610254 0.90 ADAMTS5 (0.76) ADAMTS5ADAMTS4TP53POLBMEN1
SCHEMBL1814298 0.89 ADAMTS5 (0.76) ADAMTS5ADAMTS4TP53POLBMEN1
SCHEMBL1815938 0.88 ADAMTS5 (1.00) ADAMTS5ADAMTS4TP53POLBMEN1
SCHEMBL1812851 0.88 ADAMTS5 (0.74) ADAMTS5ADAMTS4TP53POLBMEN1
SCHEMBL1813190 0.88 ADAMTS5 (1.00) ADAMTS5ADAMTS4
SCHEMBL1813188 0.88 ADAMTS5 (1.00) ADAMTS5ADAMTS4
SCHEMBL1813659 0.88 ADAMTS5 (1.00) ADAMTS5ADAMTS4
SCHEMBL2153807 0.88 ALOX12 (0.75) ADAMTS5ADAMTS4TP53POLBMEN1
SCHEMBL5090799 0.87 ADAMTS5 (0.74) ADAMTS5ADAMTS4TP53POLBMEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947712-B2 Antiarthritic agents; asthma; chronic obstructive pulminary diosrders; atherosclerosis; vision defects; hepatitis; central nervous system disorders; cardiovascular disorders; wound healing agents; restenosis; cirrhosis; multiple sclerosis; glomerulonephritis; graft versus host disease; antidiabetic agent WYETH LLC (US) 2011-05-24 US claimed
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
US-7947712-B2 Antiarthritic agents; asthma; chronic obstructive pulminary diosrders; atherosclerosis; vision defects; hepatitis; central nervous system disorders; cardiovascular disorders; wound healing agents; restenosis; cirrhosis; multiple sclerosis; glomerulonephritis; graft versus host disease; antidiabetic agent WYETH LLC (US) 2011-05-24 US disclosed
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