SCHEMBL27361713

SCHEMBL27361713

Cn1cnc(S(=O)(=O)N(Cc2ccc(C(=O)NO)cc2)Cc2cccnc2)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 10/20 0.58
HDAC8 Q9BY41 7/20 0.58
HDAC1 Q13547 4/20 0.58
HDAC3 O15379 4/20 0.58
HDAC2 Q92769 2/20 0.58
HDAC7 Q8WUI4 1/20 0.58
HDAC10 Q969S8 1/20 0.58
HDAC9 Q9UKV0 1/20 0.58
HDAC5 Q9UQL6 1/20 0.58
FNTA P49354 7/20 0.49
FNTB P49356 7/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CXCR3 P49682 1/20 0.47
HDAC11 Q96DB2 6/20 0.47
PGGT1B P53609 5/20 0.46

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
SCHEMBL27361824 0.83 HDAC6 (0.59) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL27361336 0.82 HDAC6 (0.59) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL30754589 0.80 HDAC6 (0.68) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL27361612 0.80 HDAC6 (0.68) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL27362098 0.80 HDAC6 (0.64) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL27361611 0.79 HDAC6 (0.63) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL27361516 0.78 HDAC6 (0.68) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL22483025 0.78 HDAC6 (0.78) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL27361823 0.77 HDAC6 (0.61) HDAC6HDAC8HDAC1HDAC3HDAC2
SCHEMBL27361903 0.77 HDAC6 (0.69) HDAC6HDAC8HDAC1HDAC3HDAC2

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