SCHEMBL30993458

SCHEMBL30993458

CC(C)(C)OC(=O)N1CCc2c(C3CCOCC3)n[nH]c2C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ RECQL P46063 1/20 0.41
▸ DPP4 P27487 1/20 0.39
▸ DPP8 Q6V1X1 1/20 0.39
▸ DPP9 Q86TI2 1/20 0.39
▸ DPP7 Q9UHL4 1/20 0.39
▸ ADORA1 P30542 1/20 0.39
▸ RBP4 P02753 4/20 0.38
▸ NR1H2 P55055 2/20 0.37
▸ MTOR P42345 2/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ PIK3R1 P27986 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ TNKS2 Q9H2K2 1/20 0.36
▸ PARP2 Q9UGN5 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL4762504 0.92 DPP4 (0.44) DPP4DPP8DPP9DPP7ADORA1
SCHEMBL17868689 0.85 USP2 (0.38) USP2SMN1; SMN2RECQLADORA1RBP4
SCHEMBL17868582 0.81 RBP4 (0.39) ADORA1RBP4NR1H2ESR2HTT
SCHEMBL17868644 0.81 RBP4 (0.39) ADORA1RBP4NR1H2ESR2HTT
SCHEMBL21237549 0.78 ADORA1 (0.45) USP2SMN1; SMN2DPP4DPP8DPP9
SCHEMBL17229883 0.78 ADORA1 (0.45) USP2SMN1; SMN2ADORA1NR1H2ESR2
SCHEMBL29899468 0.77 MTOR (0.42) USP2SMN1; SMN2RECQLADORA1NR1H2
SCHEMBL17317969 0.77 ADORA1 (0.50) USP2SMN1; SMN2ADORA1RBP4NR1H2
SCHEMBL19643783 0.77 ADORA1 (0.44) USP2SMN1; SMN2ADORA1NR1H2ESR2
SCHEMBL17317597 0.77 ADORA1 (0.44) USP2SMN1; SMN2ADORA1RBP4NR1H2

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-2024130095-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-06-20 — — WO disclosed
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