SCHEMBL7864147

SCHEMBL7864147

CN1CCC=C1C(=O)N1CCCc2cc(C(=O)NO)ccc2C1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 20/20 0.64
HDAC8 Q9BY41 5/20 0.64
HDAC1 Q13547 3/20 0.54
HDAC3 O15379 1/20 0.54

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
SCHEMBL12895830 0.80 HDAC6 (0.74) HDAC6HDAC8HDAC1HDAC3
SCHEMBL12896097 0.79 HDAC6 (0.69) HDAC6HDAC8HDAC1HDAC3
SCHEMBL1264164 0.78 HDAC6 (1.00) HDAC6HDAC8HDAC1HDAC3
SCHEMBL1263374 0.77 HDAC6 (0.71) HDAC6HDAC8HDAC1HDAC3
SCHEMBL1264296 0.77 HDAC6 (0.70) HDAC6HDAC8HDAC1HDAC3
SCHEMBL7864226 0.77 HDAC6 (0.64) HDAC6HDAC8HDAC1HDAC3
SCHEMBL1263779 0.77 HDAC6 (0.66) HDAC6HDAC8HDAC1HDAC3
SCHEMBL1264329 0.76 HDAC6 (1.00) HDAC6HDAC8HDAC1HDAC3
SCHEMBL1264520 0.76 HDAC6 (1.00) HDAC6HDAC8HDAC1HDAC3
SCHEMBL1262773 0.76 HDAC6 (0.64) HDAC6HDAC8HDAC1HDAC3

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