SCHEMBL7865719

SCHEMBL7865719

C/C=C1\CN(C(=O)c2cc(Cl)c(Cl)n2C)Cc2ccc(C(=O)NO)cc21

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 19/20 0.53
▸ HDAC8 Q9BY41 7/20 0.47
▸ HDAC3 O15379 3/20 0.41
▸ HDAC1 Q13547 2/20 0.41
▸ HDAC7 Q8WUI4 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC10 Q969S8 1/20 0.33
▸ HDAC11 Q96DB2 1/20 0.33
▸ HDAC5 Q9UQL6 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33

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
SCHEMBL1263310 0.77 HDAC6 (0.54) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL7868699 0.74 HDAC6 (0.61) HDAC6HDAC8HDAC3HDAC1
SCHEMBL12883241 0.72 HDAC6 (0.53) HDAC6HDAC8HDAC3HDAC1
SCHEMBL12210615 0.69 HDAC6 (1.00) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL1173979 0.67 HDAC6 (0.66) HDAC6HDAC8HDAC3HDAC1
SCHEMBL12210633 0.67 HDAC6 (0.88) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL12895868 0.66 HDAC6 (0.58) HDAC6HDAC8HDAC3HDAC1HDAC7
SCHEMBL7795811 0.65 POLB (0.40) HDAC6HDAC8HDAC1HSP90AA1
SCHEMBL1173867 0.65 HDAC6 (0.66) HDAC6HDAC8HDAC3HDAC1HSP90AA1
SCHEMBL1263733 0.64 HDAC6 (1.00) HDAC6HDAC8HDAC3HDAC1HDAC7

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-2010151318-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-12-29 — — WO disclosed
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