SCHEMBL24939368

SCHEMBL24939368

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

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 4/20 0.46
▸ CAPN1 P07384 1/20 0.46
▸ CTSB P07858 3/20 0.45
▸ CTSS P25774 2/20 0.45
▸ CTSK P43235 1/20 0.45
▸ CTSF Q9UBX1 1/20 0.45

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
SCHEMBL29179602 0.87 CTSL (0.58) CTSLCAPN1CTSB
SCHEMBL29179598 0.87 CTSL (0.58) CTSLCAPN1CTSB
SCHEMBL30852952 0.85 CTSL (0.53) CTSLCTSBCTSS
SCHEMBL29179559 0.85 CTSL (0.53) CTSLCTSBCTSS
SCHEMBL29179563 0.85 CTSL (0.53) CTSLCTSBCTSS
SCHEMBL26178972 0.82 CTSL (0.41) CTSLCAPN1CTSBCTSSCTSK
SCHEMBL25862533 0.82 CTSL (0.57) CTSLCTSBCTSSCTSK
SCHEMBL29179618 0.82 CTSL (0.57) CTSLCTSBCTSSCTSK
SCHEMBL25855508 0.82 CTSL (0.57) CTSLCTSBCTSSCTSK
SCHEMBL25222304 0.80 CTSL (0.52) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11708348-B2 Protease inhibitors for treatment of coronavirus infections THE SCRIPPS RESEARCH INSTITUTE (US) 2023-07-25 — — US disclosed
US-20230024012-A1 Protease Inhibitors for Treatment of Coronavirus Infections THE SCRIPPS RESEARCH INSTITUTE 2023-01-26 — — 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 (2 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-20230024012-A1 Protease Inhibitors for Treatment of Coronavirus Infections ACE, ACE2, TMPRSS2 CTSL 19/4885CAPN1 228/4885CTSB 15/4885
US-11708348-B2 Protease inhibitors for treatment of coronavirus infections ACE, ACE2, TMPRSS2 CTSL 19/4885CAPN1 228/4885CTSB 15/4885

“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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