SCHEMBL30466337

SCHEMBL30466337

Cc1cc2cc(B3OC(C)(C)C(C)(C)O3)n(C(=O)OC(C)(C)C)c2cc1C

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.35
NR1H2 P55055 5/20 0.32
BACE1 P56817 1/20 0.31
BACE2 Q9Y5Z0 1/20 0.31
AURKA O14965 1/20 0.31
CDK2 P24941 1/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
AAK1 Q2M2I8 2/20 0.31
NR1H3 Q13133 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
SCHEMBL25230210 1.00 USP30 (0.35) USP30NR1H2BACE1BACE2AURKA
SCHEMBL25279258 0.86 NR1H2 (0.40) USP30NR1H2AAK1NR1H3
SCHEMBL30466370 0.83 NR1H2 (0.48) NR1H2NR1H3
SCHEMBL616604 0.83 NR1H2 (0.48) NR1H2NR1H3
SCHEMBL15011465 0.82 NR1H2 (0.41) USP30NR1H2BACE1BACE2NR1H3
SCHEMBL25787198 0.82 USP30 (0.36) USP30NR1H2AURKACDK2AAK1
SCHEMBL3424231 0.82 USP30 (0.39) USP30NR1H2NR1H3
SCHEMBL31275642 0.82 MEN1 (0.32) USP30AAK1
SCHEMBL14854558 0.80 ABCB1 (0.39) NR1H2NR1H3
SCHEMBL24755242 0.80 NR1H2 (0.44) NR1H2NR1H3

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-4448105-A1 HETEROCYCLE DERIVATIVES FOR THE TREATMENT OF DISEASE VIR Biotechnology, Inc. (US) 2024-10-23 EP disclosed
WO-2023114428-A1 HETEROCYCLE DERIVATIVES FOR THE TREATMENT OF DISEASE Vir Biotechnology, Inc. (US) 2023-06-22 WO disclosed