SCHEMBL25006964

SCHEMBL25006964

CC(C)C[C@H](C)C(=O)N[C@H](CO)C[C@@H]1CCNC1=O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 3/20 0.41
▸ CAPN1 P07384 1/20 0.41
▸ CTSB P07858 2/20 0.40
▸ CTSS P25774 1/20 0.40
▸ CTSK P43235 1/20 0.40
▸ CTSF Q9UBX1 1/20 0.40

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
Hydrochloric Acid SCHEMBL6064442 0.86 CTSL (0.39) CTSLCAPN1CTSBCTSSCTSK
SCHEMBL23883338 0.85 CTSL (0.49) CTSLCAPN1CTSBCTSSCTSK
SCHEMBL28969261 0.85 CTSL (0.49) CTSLCAPN1CTSBCTSSCTSK
SCHEMBL23883336 0.85 CTSL (0.49) CTSLCAPN1CTSBCTSSCTSK
SCHEMBL23883341 0.85 CTSL (0.49) CTSLCAPN1CTSBCTSSCTSK
SCHEMBL30268715 0.83 CTSL (0.51) CTSLCAPN1CTSBCTSSCTSK
SCHEMBL23883332 0.83 CTSL (0.39) CTSLCAPN1CTSBCTSSCTSK
SCHEMBL23883330 0.83 CTSL (0.39) CTSLCAPN1CTSBCTSSCTSK
SCHEMBL25196172 0.83 CTSL (0.39) CTSLCAPN1CTSBCTSSCTSK
SCHEMBL25266635 0.83 CTSL (0.39) CTSLCAPN1CTSBCTSSCTSK

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-2023014758-A1 INHIBITORS FOR CORONAVIRUSES COCRYSTAL PHARMA, INC. (US) 2023-02-09 — — WO disclosed
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