SCHEMBL9728451

SCHEMBL9728451

COc1cc(C)c(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.50
PPARA Q07869 7/20 0.49
PPARG P37231 6/20 0.49
ITGB3 P05106 1/20 0.47
ITGA2B P08514 1/20 0.47
ITGA4 P13612 2/20 0.44
ITGB7 P26010 2/20 0.44
PTPN1 P18031 2/20 0.44
CTSS P25774 4/20 0.44
SCN9A Q15858 1/20 0.43
PPARD Q03181 2/20 0.41
CTSB P07858 2/20 0.41
CTSK P43235 2/20 0.41
CTSL P07711 1/20 0.41

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
SCHEMBL21062787 1.00 ACE (0.50) ACEPPARAPPARGITGB3ITGA2B
SCHEMBL10759759 0.90 KLK5 (0.47) ACEPPARAPPARGCTSSSCN9A
SCHEMBL10604860 0.88 ACE (0.53) ACEPPARAPPARGITGB3ITGA2B
SCHEMBL2890189 0.88 ACE (0.53) ACEPPARAPPARGITGB3ITGA2B
SCHEMBL12961555 0.88 ACE (0.48) ACEPPARAPPARGITGB3ITGA2B
SCHEMBL1062205 0.88 ACE (0.48) ACEPPARAPPARGITGB3ITGA2B
SCHEMBL1055585 0.87 ACE (0.52) ACEPPARAPPARGITGB3ITGA2B
SCHEMBL2263756 0.87 ACE (0.52) ACEPPARAPPARGITGB3ITGA2B
SCHEMBL5924671 0.86 PTPN1 (0.50) ACEPPARAPPARGITGB3ITGA2B
SCHEMBL5924674 0.86 PTPN1 (0.50) ACEPPARAPPARGITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240059734-A1 MITOCHONDRIA-TARGETING PEPTIDES STEALTH BIOTHERAPEUTICS INC. 2024-02-22 US disclosed
US-11795196-B2 Mitochondria-targeting peptides STEALTH BIOTHERAPEUTICS INC. (US) 2023-10-24 US disclosed
EP-4218785-A2 MITOCHONDRIA-TARGETING PEPTIDES Stealth BioTherapeutics Inc. (US) 2023-08-02 EP disclosed
US-20230146515-A1 MITOCHONDRIA-TARGETING PEPTIDES STEALTH BIOTHERAPEUTICS INC. 2023-05-11 US disclosed
EP-3723783-B1 MITOCHONDRIA-TARGETING PEPTIDES STEALTH BIOTHERAPEUTICS INC (US) 2023-02-15 EP disclosed
EP-3723783-A1 MITOCHONDRIA-TARGETING PEPTIDES Stealth Biotherapeutics Corp (MC) 2020-10-21 EP disclosed
WO-2019118878-A1 MITOCHONDRIA-TARGETING PEPTIDES STEALTH BIOTHERAPEUTICS CORP. (MC) 2019-06-20 WO disclosed
US-5169833-A Analgesics G. D. SEARLE & CO. (US) 1992-12-08 US disclosed
US-4760180-A N-terminally substituted dipeptide amides G. D. SEARLE & CO. (US) 1988-07-26 US disclosed
EP-0213481-A2 N-terminally substituted dipeptide amides No. 2 G.D. Searle & Co. (US) 1987-03-11 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 (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-11795196-B2 Mitochondria-targeting peptides HSPE1, TFAM, TNNI3 ACE 4361/4885PPARA 1208/4885PPARG 1157/4885
US-20240059734-A1 MITOCHONDRIA-TARGETING PEPTIDES HSPE1, TFAM, TNNI3 ACE 4361/4885PPARA 1208/4885PPARG 1157/4885
US-20230146515-A1 MITOCHONDRIA-TARGETING PEPTIDES HSPE1, TFAM, TNNI3 ACE 4361/4885PPARA 1208/4885PPARG 1157/4885

“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.