SCHEMBL30409371

SCHEMBL30409371

Fc1cc(-c2cn(Cc3ncc(-c4nnc(C(F)F)o4)cc3F)nn2)ccc1CN1CCC1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 1/20 0.42
▸ HDAC6 Q9UBN7 6/20 0.40
▸ HDAC1 Q13547 12/20 0.39

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
SCHEMBL24217084 1.00 LRRK2 (0.42) LRRK2HDAC6HDAC1
SCHEMBL25356167 0.98 LRRK2 (0.42) LRRK2HDAC6HDAC1
SCHEMBL25350086 0.97 LRRK2 (0.41) LRRK2HDAC6HDAC1
SCHEMBL25348179 0.93 HDAC6 (0.41) LRRK2HDAC6HDAC1
SCHEMBL30409874 0.90 HDAC6 (0.48) HDAC6HDAC1
SCHEMBL24215810 0.90 HDAC6 (0.48) HDAC6HDAC1
SCHEMBL30460258 0.89 HDAC6 (0.48) HDAC6HDAC1
SCHEMBL24216144 0.89 HDAC6 (0.48) HDAC6HDAC1
SCHEMBL24216208 0.88 HDAC6 (0.41) LRRK2HDAC6HDAC1
SCHEMBL25429751 0.87 HDAC6 (0.42) LRRK2HDAC6HDAC1

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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