SCHEMBL31532608

SCHEMBL31532608

CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)c2sc(-c3ccc(-c4ccncc4)cc3)cc2NC(N)=O)C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 4/20 0.56
▸ CHEK1 O14757 11/20 0.48
▸ PARP1 P09874 1/20 0.48
▸ MELK Q14680 3/20 0.46
▸ HDAC4 P56524 1/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.46
▸ PLK4 O00444 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

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
SCHEMBL31532589 0.96 USP30 (0.60) USP30CHEK1PARP1MELKPLK4
SCHEMBL1564575 0.90 USP30 (0.55) USP30CHEK1PARP1MELKPLK4
SCHEMBL31532676 0.90 USP30 (0.55) USP30CHEK1PARP1MELKPLK4
SCHEMBL31532672 0.89 USP30 (0.56) USP30PARP1HDAC4HDAC6BTK
SCHEMBL31532576 0.88 USP30 (0.52) USP30CHEK1MELKHDAC4HDAC6
SCHEMBL31532583 0.88 USP30 (0.52) USP30CHEK1MELKHDAC4HDAC6
SCHEMBL31532629 0.87 USP30 (0.58) USP30CHEK1PARP1MELKPLK4
SCHEMBL31532687 0.87 CHEK1 (0.62) USP30CHEK1PARP1MELKPLK4
SCHEMBL12649363 0.87 CHEK1 (0.62) USP30CHEK1PARP1MELKPLK4
SCHEMBL31532635 0.87 USP30 (0.58) USP30CHEK1PARP1MELKPLK4

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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