SCHEMBL26051181

SCHEMBL26051181

CNCCCC1CC(N2CCc3cc(C(=O)NO)cnc3C2)C1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 15/20 0.39
ADRA1A P35348 2/20 0.33
HDAC8 Q9BY41 2/20 0.33
HRH3 Q9Y5N1 3/20 0.32
KDM1A O60341 1/20 0.32
HDAC3 O15379 3/20 0.32
HDAC1 Q13547 3/20 0.32
HDAC2 Q92769 2/20 0.31

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
SCHEMBL26052166 0.83 HDAC6 (0.38) HDAC6ADRA1AHDAC8HRH3HDAC3
SCHEMBL26052112 0.81 HDAC6 (0.39) HDAC6ADRA1AHDAC8HRH3HDAC3
SCHEMBL26051182 0.80 HDAC6 (0.35) HDAC6HDAC8HRH3KDM1AHDAC3
SCHEMBL26062081 0.80 HDAC6 (0.35) HDAC6HDAC8HRH3KDM1AHDAC3
SCHEMBL26051040 0.80 HDAC6 (0.54) HDAC6ADRA1AHDAC8HRH3HDAC3
SCHEMBL26051086 0.78 HDAC6 (0.50) HDAC6ADRA1AHDAC8HRH3HDAC3
SCHEMBL26050849 0.78 HDAC6 (0.61) HDAC6HRH3
SCHEMBL10224172 0.78 HDAC6 (0.58) HDAC6HRH3HDAC3HDAC1HDAC2
SCHEMBL720809 0.78 HDAC6 (0.45) HDAC6ADRA1AHDAC8HRH3HDAC3
SCHEMBL26050862 0.77 HDAC6 (0.46) HDAC6ADRA1AHDAC8HDAC3HDAC1

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