SCHEMBL12283635

SCHEMBL12283635

C/C=C(/C(=O)N1Cc2cc(C(=O)NO)cn2CC1C)N(C)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 14/20 0.41
▸ HDAC1 Q13547 5/20 0.38
▸ HDAC8 Q9BY41 3/20 0.38
▸ HDAC3 O15379 2/20 0.38
▸ HDAC2 Q92769 2/20 0.38
▸ HDAC7 Q8WUI4 1/20 0.38
▸ HDAC10 Q969S8 1/20 0.38
▸ HDAC11 Q96DB2 1/20 0.38
▸ HDAC5 Q9UQL6 1/20 0.38

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
SCHEMBL12210784 0.76 HDAC6 (0.64) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL12210946 0.74 HDAC6 (0.41) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL12211016 0.72 HDAC6 (0.44) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL2522196 0.71 HDAC6 (0.67) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL12211089 0.71 HDAC6 (0.48) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL12210803 0.70 HDAC6 (0.67) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL12210759 0.68 GRM1 (0.44) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL2519323 0.68 HDAC6 (0.53) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL12211086 0.68 HDAC6 (0.47) HDAC6HDAC1HDAC8HDAC3HDAC2
SCHEMBL12210979 0.64 HDAC6 (0.62) HDAC6HDAC1HDAC8HDAC3HDAC2

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-2011130163-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-10-20 — — WO disclosed
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