SCHEMBL14340367

SCHEMBL14340367

Nn1cc(CCNCc2ccc(/C=C/C(=O)NO)cc2)c2cc(OCCCc3ccccc3)ccc21

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 19/20 0.59
▸ HDAC3 O15379 16/20 0.59
▸ HDAC6 Q9UBN7 15/20 0.59
▸ HDAC2 Q92769 15/20 0.59
▸ HDAC8 Q9BY41 15/20 0.59
▸ HDAC4 P56524 14/20 0.59
▸ HDAC7 Q8WUI4 14/20 0.59
▸ HDAC9 Q9UKV0 14/20 0.59
▸ HDAC5 Q9UQL6 14/20 0.59
▸ HDAC10 Q969S8 13/20 0.59
▸ HDAC11 Q96DB2 13/20 0.59
▸ KCNH2 Q12809 1/20 0.49

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
SCHEMBL8242116 0.83 HDAC1 (0.84) HDAC1HDAC3HDAC6HDAC2HDAC8
SCHEMBL8241707 0.79 HDAC1 (0.86) HDAC1HDAC3HDAC6HDAC2HDAC8
SCHEMBL8278533 0.75 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC2HDAC8
SCHEMBL13949796 0.75 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC2HDAC8
SCHEMBL8243307 0.73 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC2HDAC8
SCHEMBL8236096 0.72 HDAC1 (0.74) HDAC1HDAC3HDAC6HDAC2HDAC8
SCHEMBL18085938 0.72 HDAC1 (1.00) HDAC1HDAC3HDAC6HDAC2HDAC8
SCHEMBL8242464 0.71 HDAC1 (0.75) HDAC1HDAC3HDAC6HDAC2HDAC8
SCHEMBL8255178 0.70 HDAC1 (0.53) HDAC1HDAC3HDAC6HDAC2HDAC8
SCHEMBL8256750 0.70 HDAC1 (0.57) HDAC1HDAC3HDAC6HDAC2HDAC8

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
EP-1870399-A1 HYDROXAMATE DERIVATIVES USEFUL AS DEACETYLASE INHIBITORS Novartis AG (CH) 2007-12-26 — — EP disclosed
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