SCHEMBL26050772

SCHEMBL26050772

O=C(NO)c1cnc2c(c1)CCN(CC1CCC1)C2

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 13/20 0.45
HDAC1 Q13547 4/20 0.38
HDAC3 O15379 3/20 0.38
HDAC2 Q92769 3/20 0.38
HDAC10 Q969S8 2/20 0.38
HDAC8 Q9BY41 2/20 0.38
HDAC4 P56524 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
KDM2B Q8NHM5 1/20 0.36
HRH3 Q9Y5N1 2/20 0.35
ENPP2 Q13822 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
SCHEMBL26050856 0.97 HDAC6 (0.49) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL26050771 0.95 HDAC6 (0.44) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL26056160 0.89 HDAC6 (0.45) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL26050864 0.88 HDAC6 (0.39) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL26051877 0.86 HDAC6 (0.42) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL26051875 0.86 HDAC6 (0.37) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL26051876 0.85 HDAC6 (0.37) HDAC6HDAC1HDAC3HDAC2HDAC8
SCHEMBL26050917 0.85 HDAC6 (0.41) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL26050918 0.85 HDAC6 (0.41) HDAC6HDAC1HDAC3HDAC2HDAC10
SCHEMBL26050852 0.85 HDAC6 (0.41) HDAC6HDAC1HDAC3HDAC2HDAC10

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