SCHEMBL30722353

SCHEMBL30722353

CC(C)(C)OC(=O)N(CCc1ccccc1)C1CNC(C(=O)O)C1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
OPRM1 P35372 2/20 0.37
PKM P14618 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
HIF1A Q16665 1/20 0.34
SSTR4 P31391 1/20 0.34
AGTR2 P50052 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL26966058 1.00 HSD11B1 (0.39) HSD11B1DPP8DPP7OPRM1PKM
SCHEMBL11045927 0.89 HSD11B1 (0.49) HSD11B1DPP8DPP7L3MBTL1JAK2
SCHEMBL26966078 0.89 HSD11B1 (0.49) HSD11B1DPP8DPP7L3MBTL1JAK2
SCHEMBL11045925 0.89 HSD11B1 (0.49) HSD11B1DPP8DPP7L3MBTL1JAK2
SCHEMBL30722334 0.89 HSD11B1 (0.49) HSD11B1DPP8DPP7L3MBTL1JAK2
SCHEMBL26966073 0.80 CYP1A2 (0.37) HSD11B1
SCHEMBL19260910 0.79 OPRM1 (0.45) HSD11B1OPRM1PKML3MBTL1
SCHEMBL30722344 0.78 OPRM1 (0.42) HSD11B1OPRM1PKML3MBTL1MEN1
SCHEMBL21315783 0.77 CYP1A2 (0.35)
Formic Acid SCHEMBL27903276 0.77 L3MBTL1 (0.47) HSD11B1OPRM1PKML3MBTL1MEN1

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-4540267-A1 CYCLIC PEPTIDES FOR TRAPPING INTERLEUKIN-1 BETA Merck Sharp & Dohme LLC (US) 2025-04-23 EP disclosed
WO-2023244554-A1 CYCLIC PEPTIDES FOR TRAPPING INTERLEUKIN-1 BETA MERCK SHARP & DOHME LLC (US) 2023-12-21 WO disclosed