SCHEMBL31628061

SCHEMBL31628061

CC(C)(C)OC(=O)N[C@H]1CSc2cc(F)c(C(=O)NNC(=O)C(C)(C)C#N)cc2NC1=O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.34

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
SCHEMBL31375537 1.00 GAA (0.34) GAA
SCHEMBL26961757 0.90 GAA (0.36) GAA
SCHEMBL29796749 0.90 GAA (0.36) GAA
SCHEMBL30830313 0.86 GAA (0.34) GAA
SCHEMBL31375584 0.85 KMT2A (0.36) GAA
SCHEMBL31628211 0.85 KMT2A (0.36) GAA
SCHEMBL29797018 0.84 GAA (0.38) GAA
SCHEMBL26961679 0.84 GAA (0.38) GAA
SCHEMBL31374892 0.84 GAA (0.38) GAA
SCHEMBL29796806 0.83 GAA (0.33) GAA

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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