SCHEMBL6881073

SCHEMBL6881073

CN(CCCCCCC(N)=O)C(=O)c1ccc(C(O)(c2ccccc2F)c2ccccc2F)cc1

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 19/20 0.79
HDAC3 O15379 1/20 0.47
HDAC1 Q13547 1/20 0.47

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
SCHEMBL2353675 0.88 HDAC6 (1.00) HDAC6
SCHEMBL6881249 0.78 HDAC6 (0.79) HDAC6HDAC3HDAC1
SCHEMBL2225861 0.76 HDAC6 (1.00) HDAC6HDAC3HDAC1
SCHEMBL2357401 0.75 HDAC6 (1.00) HDAC6
SCHEMBL2227981 0.70 HDAC6 (1.00) HDAC6HDAC3HDAC1
SCHEMBL2227499 0.70 HDAC6 (1.00) HDAC6HDAC3HDAC1
SCHEMBL2223903 0.70 HDAC6 (1.00) HDAC6
SCHEMBL2225470 0.69 HDAC6 (1.00) HDAC6
SCHEMBL8641718 0.69 HDAC6 (0.59) HDAC6HDAC3HDAC1
SCHEMBL11210960 0.69 HDAC6 (0.59) HDAC6HDAC3HDAC1

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 disclosed