SCHEMBL30409958

SCHEMBL30409958

O=Cc1cc(-c2cn(Cc3ccc(-c4nnc(C(F)F)o4)cc3F)nn2)cs1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 5/20 0.41
▸ HDAC1 Q13547 15/20 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
SCHEMBL24216066 1.00 HDAC6 (0.41) HDAC6HDAC1
SCHEMBL25351906 0.89 HDAC6 (0.44) HDAC6HDAC1
SCHEMBL30409452 0.88 HDAC1 (0.40) HDAC6HDAC1
SCHEMBL24216985 0.88 HDAC1 (0.40) HDAC6HDAC1
SCHEMBL25351043 0.86 HDAC6 (0.41) HDAC6HDAC1
SCHEMBL25351828 0.85 HDAC6 (0.42) HDAC6HDAC1
SCHEMBL30409434 0.85 HDAC1 (0.41) HDAC6HDAC1
SCHEMBL25351014 0.85 HDAC1 (0.41) HDAC6HDAC1
SCHEMBL25351959 0.85 HDAC1 (0.43) HDAC6HDAC1
SCHEMBL25350410 0.85 HDAC6 (0.45) HDAC6HDAC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4185586-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Chong Kun Dang Pharmaceutical Corp. (KR) 2023-05-31 — — EP disclosed
CN-116133658-A Novel compounds as inhibitors of histone deacetylase 6 and pharmaceutical compositions comprising the same 株式会社 钟根堂 2023-05-16 — — CN disclosed
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