SCHEMBL2226155

SCHEMBL2226155

CN(CCCCCCC(=O)NO)C(=O)c1ccc(C(O)Cc2ccccn2)cc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 20/20 0.64
HDAC3 O15379 1/20 0.55
HDAC4 P56524 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC7 Q8WUI4 1/20 0.55
HDAC2 Q92769 1/20 0.55
HDAC10 Q969S8 1/20 0.55
HDAC11 Q96DB2 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC9 Q9UKV0 1/20 0.55
HDAC5 Q9UQL6 1/20 0.55

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
SCHEMBL2225870 0.88 HDAC6 (0.61) HDAC6HDAC1
SCHEMBL2226159 0.83 HDAC6 (0.63) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL2225098 0.81 HDAC6 (0.62) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL2225157 0.80 HDAC6 (0.66) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL2224837 0.79 HDAC6 (1.00) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL2225510 0.77 HDAC6 (1.00) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL15525296 0.77 HDAC6 (0.81) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL2225943 0.76 HDAC6 (1.00) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL2225875 0.76 HDAC6 (0.60) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL2140684 0.76 HDAC6 (1.00) HDAC6HDAC3HDAC4HDAC1HDAC7

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-2011091213-A2 REVERSE AMIDE COMPOUNDS AS PROTEIN DEACETYLASE INHIBITORS AND METHODS OF USE THEREOF ACETYLON PHARMACEUTICALS (US) 2011-07-28 WO claimed