SCHEMBL26051972

SCHEMBL26051972

O=C(NO)c1cnc2c(c1)CCN(CC13CC(C1)N(C1CC1)C3)C2

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 14/20 0.37
HDAC1 Q13547 4/20 0.32
HDAC3 O15379 2/20 0.31
HDAC2 Q92769 2/20 0.31
HDAC8 Q9BY41 1/20 0.31
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 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
SCHEMBL26056262 0.93 HDAC6 (0.38) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL26051970 0.88 HDAC6 (0.36) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL26052031 0.86 HDAC6 (0.35) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL26051963 0.84 HDAC6 (0.35) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL26051962 0.84 HDAC6 (0.35) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL26050915 0.83 HDAC6 (0.44) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL26056261 0.81 HDAC6 (0.39) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL26052041 0.81 HDAC6 (0.37) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL26051966 0.80 HDAC6 (0.37) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL26050863 0.78 HDAC6 (0.39) HDAC6HDAC1HDAC3HDAC2HDAC8

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