SCHEMBL29063151

SCHEMBL29063151

COc1cccc2[nH]c(C(=O)NC(CC3CCC3)C(=O)NC(CC3CCNC3=O)C(N)=O)cc12

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSB P07858 5/20 0.69
▸ CTSL P07711 4/20 0.69
▸ CTSS P25774 4/20 0.65

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
SCHEMBL30008885 1.00 CTSB (0.69) CTSBCTSLCTSS
SCHEMBL24021102 1.00 CTSB (0.69) CTSBCTSLCTSS
SCHEMBL30008386 0.98 CTSL (0.68) CTSBCTSLCTSS
SCHEMBL23824485 0.98 CTSL (0.68) CTSBCTSLCTSS
SCHEMBL23824490 0.98 CTSL (0.68) CTSBCTSLCTSS
SCHEMBL23824488 0.98 CTSL (0.68) CTSBCTSLCTSS
SCHEMBL23824310 0.97 CTSB (0.71) CTSBCTSLCTSS
SCHEMBL23824312 0.97 CTSB (0.71) CTSBCTSLCTSS
SCHEMBL23824313 0.97 CTSB (0.71) CTSBCTSLCTSS
SCHEMBL23824477 0.94 CTSB (0.67) CTSBCTSLCTSS

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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