SCHEMBL31532647

SCHEMBL31532647

CC(C)(C)OC(=O)N1CCCC[C@@H](NC(=O)c2sc(-c3cccc(F)c3)cc2N)C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 7/20 0.56
▸ HDAC4 P56524 2/20 0.46
▸ HDAC6 Q9UBN7 2/20 0.46
▸ MELK Q14680 3/20 0.46
▸ PLK4 O00444 1/20 0.46
▸ CHEK1 O14757 1/20 0.46
▸ GAK O14976 1/20 0.46
▸ JAK2 O60674 1/20 0.46
▸ ULK1 O75385 1/20 0.46
▸ RPS6KA4 O75676 1/20 0.46
▸ STK10 O94804 1/20 0.46
▸ PRKD3 O94806 1/20 0.46
▸ MAP4K4 O95819 1/20 0.46
▸ PAK4 O96013 1/20 0.46
▸ ABL1 P00519 1/20 0.46
▸ EGFR P00533 1/20 0.46
▸ LCK P06239 1/20 0.46
▸ FYN P06241 1/20 0.46
▸ FES P07332 1/20 0.46
▸ YES1 P07947 1/20 0.46

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
SCHEMBL31532519 1.00 USP30 (0.56) USP30HDAC4HDAC6MELKPLK4
SCHEMBL1770908 0.97 USP30 (0.59) USP30HDAC4HDAC6MELKPLK4
SCHEMBL31532636 0.97 USP30 (0.59) USP30HDAC4HDAC6MELKPLK4
SCHEMBL31532675 0.97 USP30 (0.59) USP30HDAC4HDAC6MELKPLK4
SCHEMBL31532558 0.94 USP30 (0.54) USP30HDAC4HDAC6MELKPLK4
SCHEMBL31532646 0.94 USP30 (0.54) USP30HDAC4HDAC6MELKPLK4
SCHEMBL31532597 0.90 USP30 (0.52) USP30HDAC4HDAC6CHEK1BTK
SCHEMBL31532630 0.90 USP30 (0.52) USP30HDAC4HDAC6CHEK1BTK
SCHEMBL31532574 0.89 USP30 (0.47) USP30HDAC4MELKPLK4CHEK1
SCHEMBL31532628 0.89 CHEK1 (0.62) USP30MELKPLK4CHEK1GAK

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-4552639-A1 COMPOUNDS FOR USE IN THE TREATMENT OF GASTROINTESTINAL STROMAL TUMOR (GIST) Universität Duisburg-Essen (DE) 2025-05-14 — — EP disclosed
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