SCHEMBL31409565

SCHEMBL31409565

CC(C)(C)OC(=O)n1cc(B2OC(C)(C)C(C)(C)O2)c2c(Cl)nccc21

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.38
POLB P06746 1/20 0.36
AAK1 Q2M2I8 2/20 0.33
ATR Q13535 1/20 0.33
LIPE Q05469 2/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
BUB1 O43683 1/20 0.31
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31
DGAT1 O75907 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
UCHL1 P09936 1/20 0.31
HTR6 P50406 1/20 0.30

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
SCHEMBL26930227 0.80 USP30 (0.40) USP30POLBAAK1LIPEPRMT5
SCHEMBL30674343 0.80 USP30 (0.40) USP30POLBAAK1LIPEPRMT5
SCHEMBL23089644 0.79 USP30 (0.38) USP30POLBAAK1L3MBTL1BUB1
SCHEMBL29814546 0.79 USP30 (0.38) USP30POLBAAK1L3MBTL1BUB1
SCHEMBL29736431 0.78 PIM1 (0.37) USP30PRMT5WDR77L3MBTL1BUB1
SCHEMBL23089111 0.78 PIM1 (0.37) USP30PRMT5WDR77L3MBTL1BUB1
SCHEMBL23089278 0.78 USP30 (0.37) USP30AAK1LIPEPRMT5WDR77
SCHEMBL29736467 0.78 USP30 (0.37) USP30AAK1LIPEPRMT5WDR77
SCHEMBL31409645 0.77 POLB (0.42) POLBATRL3MBTL1BUB1BRD4
SCHEMBL31409613 0.77 POLB (0.42) USP30POLBATRL3MBTL1BUB1

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-2025026997-A1 SUBSTITUED BICYCLIC HETEROCYCLIC YAP-TEAD AND/OR TAZ-TEAD INHIBITORS MERCK PATENT GMBH (DE) 2025-02-06 WO disclosed