SCHEMBL29063284

SCHEMBL29063284

CC(C)(C)OC(=O)N[C@@H](CC1CC1)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 3/20 0.54
▸ CTSB P07858 2/20 0.54
▸ CTSS P25774 2/20 0.54
▸ CTSK P43235 2/20 0.54
▸ IDO1 P14902 1/20 0.45

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
SCHEMBL29063289 1.00 CTSL (0.54) CTSLCTSBCTSSCTSKIDO1
SCHEMBL30009598 1.00 CTSL (0.54) CTSLCTSBCTSSCTSKIDO1
SCHEMBL29062838 1.00 CTSL (0.54) CTSLCTSBCTSSCTSKIDO1
SCHEMBL23824669 0.95 CTSS (0.56) CTSLCTSBCTSSCTSK
SCHEMBL23824334 0.95 CTSS (0.56) CTSLCTSBCTSSCTSK
SCHEMBL23824331 0.95 CTSS (0.56) CTSLCTSBCTSSCTSK
SCHEMBL23824328 0.95 CTSS (0.56) CTSLCTSBCTSSCTSK
SCHEMBL23824449 0.94 CTSS (0.52) CTSLCTSBCTSSCTSKIDO1
SCHEMBL23824452 0.94 CTSS (0.52) CTSLCTSBCTSSCTSKIDO1
SCHEMBL29062824 0.94 CTSS (0.52) CTSLCTSBCTSSCTSKIDO1

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
CN-116685576-A Cysteine protease inhibitors and methods of use thereof 美商帕迪斯生物科学公司 2023-09-01 — — CN disclosed
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