SCHEMBL25345323

SCHEMBL25345323

CC(C)(C)OC(=O)N[C@@H](Cc1cc(Cl)ccc1C#N)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSL P07711 4/20 0.53
PTPN1 P18031 1/20 0.49
CTSS P25774 15/20 0.48
CTSK P43235 14/20 0.48
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
ACE P12821 1/20 0.47
CTSB P07858 4/20 0.47
TRPA1 O75762 1/20 0.43

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
SCHEMBL25345326 1.00 CTSL (0.53) CTSLPTPN1CTSSCTSKPPARG
SCHEMBL29481061 0.90 CTSL (0.50) CTSLCTSSCTSKCTSBTRPA1
SCHEMBL27207487 0.84 PPARA (0.51) CTSLPTPN1CTSSCTSKPPARG
SCHEMBL29907919 0.84 CTSS (0.60) CTSLPTPN1CTSSCTSKPPARG
SCHEMBL27203760 0.84 PPARA (0.51) CTSLPTPN1CTSSCTSKPPARG
SCHEMBL17912348 0.84 CTSS (0.60) CTSLPTPN1CTSSCTSKPPARG
SCHEMBL3812344 0.84 CTSS (0.60) CTSLPTPN1CTSSCTSKPPARG
SCHEMBL3812341 0.84 CTSS (0.60) CTSLPTPN1CTSSCTSKPPARG
SCHEMBL29842925 0.84 CTSS (0.60) CTSLPTPN1CTSSCTSKPPARG
SCHEMBL31276738 0.83 CTSS (0.53) CTSLPTPN1CTSSCTSKPPARG

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-20240083839-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AND DISORDERS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-03-14 US disclosed
EP-4225730-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AND DISORDERS The Regents of the University of California (US) 2023-08-16 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 (1 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-20240083839-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASES AND DISORDERS PRMT8, SIRT1, PRMT3 CTSL 4256/4885PTPN1 3988/4885CTSS 3397/4885

“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.