SCHEMBL6532808

SCHEMBL6532808

Cc1ccc([C@@H](C)n2c(-c3cccc(/C=C/C(=O)NO)c3)nc3ccccc32)cc1

nearest known ligand 0.89

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 20/20 0.89
HDAC8 Q9BY41 20/20 0.89
HDAC6 Q9UBN7 20/20 0.89

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
SCHEMBL6532814 1.00 HDAC1 (0.89) HDAC1HDAC8HDAC6
SCHEMBL6532812 1.00 HDAC1 (0.89) HDAC1HDAC8HDAC6
SCHEMBL5560902 0.94 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL5560896 0.94 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL5566777 0.94 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL5566770 0.94 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL5560899 0.94 HDAC1 (1.00) HDAC1HDAC8HDAC6
SCHEMBL5565872 0.94 HDAC1 (0.88) HDAC1HDAC8HDAC6
SCHEMBL5565876 0.94 HDAC1 (0.88) HDAC1HDAC8HDAC6
SCHEMBL5565871 0.94 HDAC1 (0.88) HDAC1HDAC8HDAC6

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
EP-1608628-A2 HISTONE DEACETYLASE INHIBITORS Takeda San Diego, Inc. (US) 2005-12-28 EP claimed
WO-2004082638-A2 HISTONE DEACETYLASE INHIBITORS SYRRX, INC. (US) 2004-09-30 WO claimed