SCHEMBL13019407

SCHEMBL13019407

O=C(/C=C/c1cccn(Cc2cccc(Cl)c2)c1=O)NO

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 18/20 0.78
HDAC4 P56524 18/20 0.78
HDAC1 Q13547 18/20 0.78
HDAC7 Q8WUI4 18/20 0.78
HDAC2 Q92769 18/20 0.78
HDAC10 Q969S8 18/20 0.78
HDAC11 Q96DB2 18/20 0.78
HDAC8 Q9BY41 18/20 0.78
HDAC6 Q9UBN7 18/20 0.78
HDAC9 Q9UKV0 18/20 0.78
HDAC5 Q9UQL6 18/20 0.78
EGLN1 Q9GZT9 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
SCHEMBL13019411 0.89 HDAC3 (0.78) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13019955 0.88 HDAC3 (0.82) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13020396 0.88 HDAC3 (0.81) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13020389 0.87 HDAC3 (0.79) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13019448 0.87 HDAC3 (1.00) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13019787 0.87 EGLN1 (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13019749 0.87 HDAC3 (0.79) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13020325 0.86 HDAC3 (0.78) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13019778 0.85 HDAC3 (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1607554 0.85 HDAC4 (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010140835-A2 NOVEL PYRIDONE COMPOUNDS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, METHOD FOR PRODUCING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME FOR TREATING CANCER 연세대학교 산학협력단 (KR) 2010-12-09 WO disclosed