SCHEMBL25530819

SCHEMBL25530819

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

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 1/20 0.48
▸ CTSL P07711 2/20 0.38
▸ CAPN1 P07384 1/20 0.38
▸ CTSB P07858 1/20 0.38

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
SCHEMBL30823567 0.89 NOD1 (0.41) NOD1CTSLCTSB
SCHEMBL24939481 0.88 NOD1 (0.42) NOD1CTSLCTSB
SCHEMBL24939438 0.82 CTSV (0.55) CTSLCTSB
SCHEMBL23721402 0.81 CTSL (0.45) CTSLCTSB
SCHEMBL30174896 0.81 CTSL (0.45) CTSLCTSB
SCHEMBL24939293 0.81 CTSV (0.48) CTSLCTSB
SCHEMBL29613837 0.78 CTSL (0.41) NOD1CTSLCTSB
SCHEMBL28732893 0.78 CTSL (0.41) NOD1CTSLCTSB
SCHEMBL23824251 0.78 CTSL (0.43) CTSLCAPN1CTSB
SCHEMBL23824248 0.78 CTSL (0.43) CTSLCAPN1CTSB

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
US-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION COCRYSTAL PHARMA, INC. 2023-05-25 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION VIM, ACE, ACE2 NOD1 4243/4885CTSL 1031/4885CAPN1 787/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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