SCHEMBL26051170

SCHEMBL26051170

CC(=O)N1CCCC(N2CCc3cc(C(=O)NO)cnc3C2)C1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 11/20 0.47
KDM6B O15054 1/20 0.39
KDM4A O75164 1/20 0.39
KDM5C P41229 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
KDM2A Q9Y2K7 1/20 0.39
KDM3A Q9Y4C1 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HRH3 Q9Y5N1 4/20 0.37
HDAC8 Q9BY41 1/20 0.36
NAMPT P43490 1/20 0.36
HTR2A P28223 1/20 0.36
TMEM97 Q5BJF2 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
KDM2B Q8NHM5 1/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35

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
SCHEMBL26051089 0.89 HDAC6 (0.47) HDAC6HDAC3HDAC1HDAC2HDAC8
SCHEMBL26051096 0.88 HDAC6 (0.49) HDAC6HDAC3HDAC1HDAC2HRH3
SCHEMBL10224172 0.87 HDAC6 (0.58) HDAC6HDAC3HDAC1HDAC2HRH3
SCHEMBL26050849 0.87 HDAC6 (0.61) HDAC6HRH3KDM2B
SCHEMBL26051169 0.86 HDAC6 (0.53) HDAC6HRH3KDM2B
SCHEMBL26050922 0.86 HDAC6 (0.57) HDAC6HDAC3HDAC1HDAC2HRH3
SCHEMBL26062657 0.85 HDAC6 (0.52) HDAC6HDAC3HDAC1HDAC2HRH3
SCHEMBL26051040 0.85 HDAC6 (0.54) HDAC6HDAC3HDAC1HDAC2HRH3
SCHEMBL26051720 0.83 HDAC6 (0.45) HDAC6HDAC3HDAC1HDAC2HRH3
SCHEMBL26051086 0.83 HDAC6 (0.50) HDAC6HDAC3HDAC1HRH3HDAC8

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-2023150203-A1 HDAC6 INHIBITORS AND USES THEREOF EIKONIZO THERAPEUTICS, INC. (US) 2023-08-10 WO disclosed