SCHEMBL25765362

SCHEMBL25765362

COC(=O)[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSL P07711 7/20 0.66
CTSB P07858 5/20 0.66
CAPN1 P07384 1/20 0.54
CTSS P25774 2/20 0.52
CTSK P43235 2/20 0.52
CTSF Q9UBX1 1/20 0.52

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
SCHEMBL25285672 0.94 CTSL (0.69) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25285671 0.94 CTSL (0.69) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL24691258 0.93 CTSL (0.75) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25765364 0.91 CTSL (0.65) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25765342 0.91 CTSL (0.56) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL24691263 0.91 CTSL (0.61) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25767575 0.91 CTSL (0.61) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25765392 0.90 CTSL (0.66) CTSLCTSBCAPN1CTSSCTSK
SCHEMBL25766148 0.90 CTSL (0.73) CTSLCTSB
SCHEMBL25766142 0.90 CTSL (0.73) CTSLCTSB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212116-A1 SARS-COV-2 MAIN PROTEASE INHIBITORS THE TEXAS A&M UNIVERSITY SYSTEM 2023-07-06 US disclosed
US-20230212116-A1 SARS-COV-2 MAIN PROTEASE INHIBITORS THE TEXAS A&M UNIVERSITY SYSTEM 2023-07-06 US disclosed
US-20230212116-A1 SARS-COV-2 MAIN PROTEASE INHIBITORS THE TEXAS A&M UNIVERSITY SYSTEM 2023-07-06 US disclosed
US-20220259145-A1 SARS-COV-2 MAIN PROTEASE INHIBITORS THE TEXAS A&M UNIVERSITY SYSTEM 2022-08-18 US disclosed
WO-2022020711-A1 SARS-COV-2 MAIN PROTEASE INHIBITORS THE TEXAS A&M UNIVERSITY SYSTEM (US) 2022-01-27 WO 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-20220259145-A1 SARS-COV-2 MAIN PROTEASE INHIBITORS ACE2, ACE, TMPRSS2 CTSL 26/4885CTSB 27/4885CAPN1 162/4885
US-20230212116-A1 SARS-COV-2 MAIN PROTEASE INHIBITORS ACE2, ACE, TMPRSS2 CTSL 26/4885CTSB 27/4885CAPN1 162/4885

“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.