SCHEMBL7867209

SCHEMBL7867209

CN1C=CCC1C(=O)N1CCc2cc(C(=O)NO)ccc2C1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 20/20 0.60
▸ HDAC8 Q9BY41 5/20 0.58
▸ HDAC3 O15379 1/20 0.54
▸ HDAC1 Q13547 1/20 0.54
▸ KDM1A O60341 1/20 0.41

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
SCHEMBL7787392 0.79 HDAC6 (0.61) HDAC6HDAC8KDM1A
SCHEMBL1081728 0.78 HDAC6 (0.88) HDAC6HDAC8HDAC3HDAC1
SCHEMBL1027560 0.77 HDAC6 (0.73) HDAC6HDAC8HDAC3HDAC1
SCHEMBL1264433 0.76 HDAC6 (0.71) HDAC6HDAC8HDAC3HDAC1KDM1A
SCHEMBL1028087 0.76 HDAC6 (0.93) HDAC6HDAC8HDAC3HDAC1
SCHEMBL1262847 0.76 HDAC6 (0.97) HDAC6HDAC8HDAC3HDAC1
SCHEMBL1264461 0.75 HDAC6 (1.00) HDAC6HDAC8HDAC3HDAC1
SCHEMBL1262890 0.75 HDAC6 (1.00) HDAC6HDAC8HDAC3HDAC1
SCHEMBL1264104 0.75 HDAC6 (0.77) HDAC6HDAC8HDAC3HDAC1
SCHEMBL1081445 0.74 HDAC6 (0.70) HDAC6HDAC8HDAC3HDAC1

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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