SCHEMBL27361906

SCHEMBL27361906

Cc1cc(S(=O)(=O)N(Cc2ccc(C(=O)NO)cc2)Cc2cccnc2C(F)(F)F)c(C)s1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 20/20 0.49
HDAC11 Q96DB2 12/20 0.49
HDAC8 Q9BY41 11/20 0.49
HDAC3 O15379 3/20 0.48
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 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
SCHEMBL22483010 0.83 HDAC6 (0.72) HDAC6HDAC11HDAC8HDAC3HDAC1
SCHEMBL27361905 0.81 HDAC6 (0.66) HDAC6HDAC11HDAC8HDAC3HDAC1
SCHEMBL27361977 0.80 HDAC6 (0.51) HDAC6HDAC11HDAC8HDAC3HDAC1
SCHEMBL27362150 0.72 HDAC6 (0.53) HDAC6HDAC11HDAC8HDAC3HDAC1
SCHEMBL22482764 0.72 HDAC6 (0.79) HDAC6HDAC11HDAC8HDAC3HDAC1
SCHEMBL22483015 0.66 HDAC6 (1.00) HDAC6HDAC11HDAC8HDAC3HDAC1
SCHEMBL27361516 0.66 HDAC6 (0.68) HDAC6HDAC11HDAC8HDAC3HDAC1
SCHEMBL22482723 0.65 HDAC6 (1.00) HDAC6HDAC11HDAC8HDAC3HDAC1
SCHEMBL22483017 0.64 HDAC6 (0.78) HDAC6HDAC11HDAC8HDAC3HDAC1
SCHEMBL22482769 0.63 HDAC6 (1.00) HDAC6HDAC11HDAC8HDAC3HDAC1

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-2024028654-A2 HISTONE DEACETYLASE INHIBITORS AND USE OF THE SAME THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2024-02-08 WO disclosed