SCHEMBL29063259

SCHEMBL29063259

COc1cccc2[nH]c(C(=O)NC(CC3CC3)C(=O)NC(CC3CCNC3=O)C(=O)O)cc12

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 4/20 0.72
▸ CTSB P07858 4/20 0.72
▸ CTSS P25774 3/20 0.68

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
SCHEMBL23824387 0.96 CTSL (0.69) CTSLCTSBCTSS
SCHEMBL23824384 0.96 CTSL (0.69) CTSLCTSBCTSS
SCHEMBL23824351 0.95 CTSB (0.68) CTSLCTSBCTSS
SCHEMBL23824613 0.95 CTSB (0.68) CTSLCTSBCTSS
SCHEMBL23824347 0.95 CTSB (0.68) CTSLCTSBCTSS
SCHEMBL23824293 0.94 CTSB (0.72) CTSLCTSBCTSS
SCHEMBL23824295 0.94 CTSB (0.72) CTSLCTSBCTSS
SCHEMBL23824292 0.94 CTSB (0.72) CTSLCTSBCTSS
SCHEMBL23824312 0.93 CTSB (0.71) CTSLCTSBCTSS
SCHEMBL23824313 0.93 CTSB (0.71) 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-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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