SCHEMBL25985265

SCHEMBL25985265

CC(C)(C)OC(=O)N[C@@H](CCCC(=O)OCc1ccccc1)C(=O)CBr

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.49
PPARA Q07869 2/20 0.49
ACE P12821 1/20 0.48
KLK7 P49862 2/20 0.48
KLK5 Q9Y337 2/20 0.48
CTSS P25774 2/20 0.47
CASP1 P29466 1/20 0.47
SYK P43405 1/20 0.47
MAPT P10636 1/20 0.46
PPARG P37231 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
SCHEMBL25984471 0.94 PPARA (0.51) CTSKPPARAACEKLK7KLK5
SCHEMBL22404783 0.89 CTSK (0.49) CTSKPPARAACEKLK7KLK5
SCHEMBL8178286 0.89 PPARA (0.58) CTSKPPARAACEKLK7KLK5
SCHEMBL8177426 0.89 PPARA (0.58) CTSKPPARAACEKLK7KLK5
SCHEMBL8322873 0.88 KLK5 (0.53) CTSKPPARAACEKLK7KLK5
SCHEMBL5970500 0.84 PPARA (0.52) CTSKPPARAACEKLK7KLK5
SCHEMBL23153704 0.83 CTSS (0.54) CTSKPPARAKLK7KLK5CTSS
SCHEMBL5326891 0.83 MAPT (0.59) KLK7KLK5SYKMAPT
SCHEMBL5326894 0.83 MAPT (0.59) KLK7KLK5SYKMAPT
SCHEMBL8589803 0.83 SYK (0.51) CTSKPPARAACEKLK7KLK5

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
EP-3935042-B1 CASPASE INHIBITORS AND METHODS OF USE THEREOF NOBO MEDICINE INC (KR) 2024-08-28 EP disclosed
US-12071412-B2 Caspase inhibitors and methods of use thereof NOBO MEDICINE INC. (KR) 2024-08-27 US disclosed
US-20230250067-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF NOBO MEDICINE INC. (KR) 2023-08-10 US disclosed
US-20230250067-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF NOBO MEDICINE INC. (KR) 2023-08-10 US disclosed
US-11597703-B2 Caspase inhibitors and methods of use thereof HISTOGEN, INC. (US) 2023-03-07 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 (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-20230250067-A1 CASPASE INHIBITORS AND METHODS OF USE THEREOF CASP1, CASP3, CASP7 CTSK 68/4885PPARA 3631/4885ACE 297/4885
US-12071412-B2 Caspase inhibitors and methods of use thereof CASP1, CASP3, CASP7 CTSK 68/4885PPARA 3631/4885ACE 297/4885
US-11597703-B2 Caspase inhibitors and methods of use thereof CASP1, CASP3, CASP7 CTSK 68/4885PPARA 3631/4885ACE 297/4885

“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.