SCHEMBL31628095

SCHEMBL31628095

CC(C)(C)OC(=O)N[C@H]1CSc2cc(F)c(-c3noc(O)n3)cc2NC1=O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.36
▸ HDAC6 Q9UBN7 5/20 0.36
▸ HDAC1 Q13547 4/20 0.36
▸ HDAC8 Q9BY41 4/20 0.36
▸ BDKRB1 P46663 4/20 0.35
▸ HDAC5 Q9UQL6 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ EPHX2 P34913 1/20 0.30
▸ KDM4D Q6B0I6 1/20 0.30

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
SCHEMBL31628392 0.91 HDAC6 (0.40) GAAHDAC6HDAC1HDAC8BDKRB1
SCHEMBL31375533 0.91 HDAC6 (0.40) GAAHDAC6HDAC1HDAC8BDKRB1
SCHEMBL30830371 0.87 HDAC6 (0.40) GAAHDAC6HDAC1HDAC8BDKRB1
SCHEMBL26962612 0.87 HDAC6 (0.38) GAAHDAC6HDAC1HDAC8BDKRB1
SCHEMBL29797029 0.87 HDAC6 (0.38) GAAHDAC6HDAC1HDAC8BDKRB1
SCHEMBL31628116 0.86 GAA (0.37) GAAHDAC6HDAC1HDAC8BDKRB1
SCHEMBL31375596 0.86 GAA (0.37) GAAHDAC6HDAC1HDAC8BDKRB1
SCHEMBL26962169 0.86 HDAC6 (0.39) GAAHDAC6HDAC1HDAC8BDKRB1
SCHEMBL31628240 0.86 BDKRB1 (0.35) GAAHDAC6HDAC1HDAC8BDKRB1
SCHEMBL31375592 0.86 BDKRB1 (0.35) GAAHDAC6HDAC1HDAC8BDKRB1

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-4568959-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-06-18 — — EP disclosed
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