SCHEMBL31412121

SCHEMBL31412121

O=C(O)CCCCCCN1C(=O)C/C(=C\c2ccc(C(F)(F)F)cc2)C1=O

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 20/20 0.80

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
SCHEMBL29049332 0.89 HDAC1 (1.00) HDAC1
SCHEMBL29049328 0.89 HDAC1 (1.00) HDAC1
SCHEMBL29049413 0.87 HDAC1 (0.71) HDAC1
SCHEMBL31412035 0.87 HDAC1 (0.71) HDAC1
SCHEMBL29049377 0.85 HDAC1 (0.80) HDAC1
SCHEMBL29049402 0.85 HDAC1 (0.80) HDAC1
SCHEMBL31412064 0.85 HDAC1 (0.80) HDAC1
SCHEMBL31412091 0.84 HDAC1 (0.79) HDAC1
SCHEMBL31412069 0.84 HDAC1 (0.79) HDAC1
SCHEMBL31412036 0.84 HDAC1 (0.79) HDAC1

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-2025011398-A1 HISTONE DEACETYLASE INHIBITOR AND USE 南京市鸿舜医药科技有限公司 2025-01-16 — — WO disclosed
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