SCHEMBL2125178

SCHEMBL2125178

CC(C)C[C@H](NC(=O)c1cnccn1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LONP1 P36776 13/20 0.61
PSMB5 P28074 10/20 0.59
PSMB11 A5LHX3 8/20 0.58
PSMA7 O14818 8/20 0.58
PSMB1 P20618 8/20 0.58
PSMA1 P25786 8/20 0.58
PSMA2 P25787 8/20 0.58
PSMA3 P25788 8/20 0.58
PSMA4 P25789 8/20 0.58
PSMB8 P28062 8/20 0.58
PSMB9 P28065 8/20 0.58
PSMA5 P28066 8/20 0.58
PSMB4 P28070 8/20 0.58
PSMB6 P28072 8/20 0.58
PSMB10 P40306 8/20 0.58
PSMB3 P49720 8/20 0.58
PSMB2 P49721 8/20 0.58
PSMA6 P60900 8/20 0.58
PSMA8 Q8TAA3 8/20 0.58
PSMB7 Q99436 8/20 0.58

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
SCHEMBL28349151 1.00 LONP1 (0.61) LONP1PSMB5PSMB11PSMA7PSMB1
SCHEMBL28372068 0.96 LONP1 (0.58) LONP1PSMB5PSMB11PSMA7PSMB1
SCHEMBL2125847 0.95 LONP1 (0.63) LONP1PSMB5PSMB11PSMA7PSMB1
SCHEMBL2125581 0.91 LONP1 (0.59) LONP1PSMB5PSMB11PSMA7PSMB1
SCHEMBL1913443 0.86 PSMB5 (0.76) LONP1PSMB5PSMB11PSMA7PSMB1
SCHEMBL2125752 0.86 PSMB5 (0.76) LONP1PSMB5PSMB11PSMA7PSMB1
SCHEMBL2127712 0.86 PSMB5 (0.63) LONP1PSMB5PSMB11PSMA7PSMB1
SCHEMBL2127762 0.84 PSMB5 (0.73) LONP1PSMB5PSMB11PSMA7PSMB1
SCHEMBL2126381 0.84 PSMB5 (0.72) LONP1PSMB5PSMB11PSMA7PSMB1
SCHEMBL22610052 0.84 LONP1 (0.51) LONP1PSMB5PSMB11PSMA7PSMB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159471-A1 PYRAZINOIC ACID CONJUGATES AND HYBRID CONJUGATES AUGUSTA UNIVERSITY RESEARCH INSTITUTE, INC. (US) 2023-05-25 US disclosed
US-20230159471-A1 PYRAZINOIC ACID CONJUGATES AND HYBRID CONJUGATES AUGUSTA UNIVERSITY RESEARCH INSTITUTE, INC. (US) 2023-05-25 US disclosed
US-11584725-B2 Pyrazinoic acid conjugates and hybrid conjugates AUGUSTA UNIVERSITY RESEARCH INSTITUTE, INC. (US) 2023-02-21 US disclosed
US-20200140397-A1 PYRAZINOIC ACID CONJUGATES AND HYBRID CONJUGATES AUGUSTA UNIVERSITY RESEARCH INSTITUTE, INC. 2020-05-07 US disclosed
CN-108929340-B Proline boric acid compound and preparation method and application thereof 北京大学 2019-12-13 CN disclosed
EP-2444411-B1 TRIPEPTIDE BORONIC ACID OR BORONIC ESTER, PREPARATIVE METHOD AND USE THEREOF UNIV BEIJING (CN) 2016-10-26 EP disclosed
US-9421237-B2 Tripeptide boronic acid or boronic ester, preparative method and use thereof PEKING UNIVERSITY (CN) 2016-08-23 US disclosed
US-20120135921-A1 TRIPETIDE BORONIC ACID OR BORONIC ESTER, PREPARATIVE METHOD AND USE THEREOF PEKING UNIVERSITY (CN) 2012-05-31 US disclosed
EP-2444411-A1 TRIPEPTIDE BORONIC ACID OR BORONIC ESTER, PREPARATIVE METHOD AND USE THEREOF Peking University (CN) 2012-04-25 EP 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 (4 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-11584725-B2 Pyrazinoic acid conjugates and hybrid conjugates QPCT, RARA, PNKP LONP1 3776/4885PSMB5 2826/4885PSMB11 2730/4885
US-20200140397-A1 PYRAZINOIC ACID CONJUGATES AND HYBRID CONJUGATES QPCT, RARA, PNKP LONP1 3776/4885PSMB5 2826/4885PSMB11 2730/4885
US-20120135921-A1 TRIPETIDE BORONIC ACID OR BORONIC ESTER, PREPARATIVE METHOD AND USE THEREOF BTD, PSMB11, IAPP LONP1 274/4885PSMB5 12/4885PSMB11 2/4885
US-20230159471-A1 PYRAZINOIC ACID CONJUGATES AND HYBRID CONJUGATES QPCT, RARA, PNKP LONP1 3776/4885PSMB5 2826/4885PSMB11 2730/4885

“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.