SCHEMBL29063396

SCHEMBL29063396

COC(=O)C(C[C@@H]1CCCNC1=O)NC(=O)C(CC(C)(C)F)NC(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSB P07858 3/20 0.40
▸ CTSS P25774 2/20 0.40
▸ CTSL P07711 1/20 0.39

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
SCHEMBL24021116 1.00 CTSB (0.40) CTSBCTSSCTSL
SCHEMBL24020503 0.94 CTSL (0.43) CTSBCTSL
SCHEMBL25284029 0.94 CTSL (0.43) CTSBCTSL
SCHEMBL25284030 0.94 CTSL (0.43) CTSBCTSL
SCHEMBL23824589 0.92 — —
SCHEMBL23824599 0.92 — —
SCHEMBL23824601 0.92 — —
SCHEMBL29062773 0.91 IDO1 (0.45) CTSBCTSL
SCHEMBL24754820 0.90 NFKB1 (0.41) CTSS
SCHEMBL24584247 0.90 NFKB1 (0.41) CTSS

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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