SCHEMBL29179559

SCHEMBL29179559

COCC(=O)[C@H](C[C@@H]1CCNC1=O)NC(=O)C(CC(C)C)NC(=O)C(N)=O

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 4/20 0.53
▸ CTSB P07858 4/20 0.53
▸ CTSS P25774 2/20 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
SCHEMBL29179563 1.00 CTSL (0.53) CTSLCTSBCTSS
SCHEMBL30852952 1.00 CTSL (0.53) CTSLCTSBCTSS
SCHEMBL29179602 0.90 CTSL (0.58) CTSLCTSB
SCHEMBL29179598 0.90 CTSL (0.58) CTSLCTSB
SCHEMBL25855508 0.89 CTSL (0.57) CTSLCTSBCTSS
SCHEMBL29179618 0.89 CTSL (0.57) CTSLCTSBCTSS
SCHEMBL25862533 0.89 CTSL (0.57) CTSLCTSBCTSS
SCHEMBL24939368 0.85 CTSL (0.46) CTSLCTSBCTSS
SCHEMBL29179654 0.84 CTSL (0.50) CTSLCTSBCTSS
SCHEMBL29179651 0.84 CTSL (0.50) CTSLCTSBCTSS

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-117794896-A Protease inhibitors for the treatment of coronavirus infections 斯克里普斯研究学院 2024-03-29 — — CN disclosed
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