SCHEMBL30819672

SCHEMBL30819672

CC(C)C[C@H](NC(=O)CCc1cc(F)cc(F)c1)C(=O)N[C@H](C#N)C[C@@H]1CCNC1=O

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 2/20 0.54
▸ CTSB P07858 2/20 0.54
▸ CTSS P25774 1/20 0.54

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
SCHEMBL34468082 0.90 — —
SCHEMBL29063274 0.90 — —
SCHEMBL23836173 0.90 — —
SCHEMBL23836138 0.90 — —
SCHEMBL30819718 0.86 CTSL (0.43) CTSLCTSB
SCHEMBL25794666 0.84 CTSL (0.52) CTSLCTSBCTSS
SCHEMBL24754715 0.83 — —
SCHEMBL24740379 0.82 CTSL (0.60) CTSLCTSBCTSS
SCHEMBL30819704 0.81 CTSL (0.59) CTSLCTSBCTSS
SCHEMBL29063371 0.81 CTSL (0.63) 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
WO-2024086777-A2 COMPOUNDS AND METHODS FOR TREATING DISEASES CAUSED BY VIRUSES AND BACTERIA THE TRUSTEES OF INDIANA UNIVERSITY (US) 2024-04-25 — — WO disclosed
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