SCHEMBL13625669

SCHEMBL13625669

Nc1ccc(CCC(=O)NCCC=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
HDAC1 Q13547 3/20 0.44
HDAC2 Q92769 3/20 0.44
HDAC8 Q9BY41 3/20 0.44
HDAC6 Q9UBN7 3/20 0.44
HDAC3 O15379 2/20 0.44
HDAC4 P56524 2/20 0.44
HDAC7 Q8WUI4 2/20 0.44
HDAC10 Q969S8 2/20 0.44
HDAC11 Q96DB2 2/20 0.44
HDAC9 Q9UKV0 2/20 0.44
HDAC5 Q9UQL6 2/20 0.44
HPGD P15428 1/20 0.43
MEN1 O00255 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.42
PYGL P06737 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL22403771 0.85 HPGD (0.54) POLBHPGDMEN1KMT2A
SCHEMBL15109535 0.83 HPGD (0.49) POLBHDAC1HDAC2HDAC8HDAC6
SCHEMBL13806431 0.83 POLB (0.51) POLBHDAC1HDAC2HDAC8HDAC6
SCHEMBL19647049 0.80 GAA (0.54) POLBHDAC1HDAC2HDAC8HDAC6
SCHEMBL16425208 0.79 POLB (0.51) POLBHPGDMEN1RAB9AKMT2A
SCHEMBL14147680 0.79 GAA (0.49) POLBHDAC1HDAC2HDAC8HDAC6
SCHEMBL15075046 0.77 POLB (0.56) POLBHPGDMEN1KMT2ALMNA
SCHEMBL6413637 0.76 CA1 (0.55) HDAC1HDAC2HDAC8HDAC6HDAC3
SCHEMBL13625979 0.76 HPGD (0.46) POLBHDAC1HDAC2HDAC8HDAC6
SCHEMBL15109630 0.75 KDM4E (0.74) POLBHPGDMEN1KMT2ALMNA

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
WO-2013105013-A1 MUTANT ANTIBODIES AND CONJUGATION THEREOF COVX TECHNOLOGIES IRELAND LIMITED (IE) 2013-07-18 WO disclosed
WO-2009136352-A1 ANTI-ANGIOGENIC COMPOUNDS COVX TECHNOLOGIES IRELAND, LTD. (IE) 2009-11-12 WO disclosed