SCHEMBL24710027

SCHEMBL24710027

O=CNCC(=O)NC(CC1CCNC1=O)C(=O)COC(F)(F)F

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CTSV O60911 1/20 0.49
▸ CTSL P07711 1/20 0.49
▸ CTSB P07858 1/20 0.49
▸ CTSS P25774 1/20 0.49
▸ CTSK P43235 1/20 0.49

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
SCHEMBL25573410 0.85 CTSL (0.42) CTSLCTSB
SCHEMBL24939377 0.85 CTSV (0.49) CTSVCTSLCTSBCTSSCTSK
SCHEMBL24691256 0.84 — —
SCHEMBL25863001 0.83 CTSV (0.50) CTSVCTSLCTSBCTSSCTSK
SCHEMBL25864264 0.82 CTSV (0.55) CTSVCTSLCTSBCTSSCTSK
SCHEMBL24939088 0.82 CTSV (0.51) CTSVCTSLCTSBCTSSCTSK
SCHEMBL30133371 0.82 CTSV (0.51) CTSVCTSLCTSBCTSSCTSK
SCHEMBL29179374 0.82 CTSL (0.46) CTSVCTSLCTSBCTSSCTSK
SCHEMBL24939643 0.82 CTSL (0.46) CTSVCTSLCTSBCTSSCTSK
SCHEMBL24939438 0.81 CTSV (0.55) CTSVCTSLCTSBCTSSCTSK

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-2022261473-A1 PROTEASE INHIBITORS FOR THE TREATMENT OF CORONAVIRUS INFECTIONS THE SCRIPPS RESEARCH INSTITUTE (US) 2022-12-15 — — WO disclosed
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