SCHEMBL30001311

SCHEMBL30001311

Cc1cccc2[nH]c(C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC3CCNC3=O)C(N)=O)cc12

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 4/20 0.68
▸ CTSB P07858 4/20 0.68
▸ CTSS P25774 3/20 0.64

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
SCHEMBL24691287 1.00 CTSL (0.68) CTSLCTSBCTSS
SCHEMBL30001882 0.91 CTSB (0.72) CTSLCTSBCTSS
SCHEMBL24691113 0.91 CTSB (0.82) CTSLCTSBCTSS
SCHEMBL24690927 0.91 CTSB (0.72) CTSLCTSBCTSS
SCHEMBL24690563 0.91 CTSL (0.68) CTSLCTSBCTSS
SCHEMBL30001887 0.91 CTSL (0.68) CTSLCTSBCTSS
SCHEMBL24960448 0.91 CTSL (0.69) CTSLCTSBCTSS
SCHEMBL24690929 0.91 CTSB (0.71) CTSLCTSBCTSS
SCHEMBL23824670 0.90 CTSB (0.84) CTSLCTSBCTSS
SCHEMBL24020930 0.90 CTSB (0.84) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4347034-A1 PROTEASE INHIBITORS AS ANTIVIRALS ACEA Therapeutics, Inc. (US) 2024-04-10 — — EP disclosed
WO-2022256434-A1 PROTEASE INHIBITORS AS ANTIVIRALS ACEA Therapeutics, Inc. (US) 2022-12-08 — — WO disclosed
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