SCHEMBL21704495

SCHEMBL21704495

C=CCOc1ccc(C[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)OC(C)(C)C)C(=O)OCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 16/20 0.56
F2 P00734 1/20 0.49
PRSS1 P07477 1/20 0.49
ACE P12821 2/20 0.48
CTRC Q99895 2/20 0.48
PREP P48147 1/20 0.46

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
SCHEMBL23894834 0.90 ACE (0.51) CMA1ACE
SCHEMBL9699161 0.90 CMA1 (0.65) CMA1F2PRSS1ACECTRC
SCHEMBL9699165 0.90 CMA1 (0.65) CMA1F2PRSS1ACECTRC
SCHEMBL23894836 0.88 CMA1 (0.54) CMA1F2PRSS1ACECTRC
SCHEMBL23894838 0.87 ACE (0.45) CMA1ACEPREP
SCHEMBL9699092 0.84 CMA1 (0.67) CMA1F2PRSS1ACECTRC
SCHEMBL9699084 0.84 CMA1 (0.67) CMA1F2PRSS1ACECTRC
SCHEMBL9700520 0.83 CMA1 (0.58) CMA1ACECTRCPREP
SCHEMBL9700519 0.83 CMA1 (0.58) CMA1ACECTRCPREP
SCHEMBL23894833 0.83 BCL2 (0.54) ACE

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-20230357319-A1 PROTEASOME INHIBITORS UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2023-11-09 US disclosed
US-20230357319-A1 PROTEASOME INHIBITORS UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2023-11-09 US disclosed
US-11578101-B2 Proteasome inhibitors UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2023-02-14 US disclosed
US-20210309695-A1 PROTEASOME INHIBITORS UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2021-10-07 US disclosed
WO-2020033437-A1 PROTEASOME INHIBITORS UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2020-02-13 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 (3 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-11578101-B2 Proteasome inhibitors PSMG3, PSME1, PSMB1 CMA1 713/4885F2 4853/4885PRSS1 446/4885
US-20210309695-A1 PROTEASOME INHIBITORS PSMG3, PSME1, PSMB1 CMA1 713/4885F2 4853/4885PRSS1 446/4885
US-20230357319-A1 PROTEASOME INHIBITORS PSMG3, PSME1, PSMB1 CMA1 713/4885F2 4853/4885PRSS1 446/4885

“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.