SCHEMBL5710967

SCHEMBL5710967

NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.61
OPRM1 P35372 1/20 0.54
ACE2 Q9BYF1 5/20 0.52
LTA4H P09960 2/20 0.52
TSHR P16473 1/20 0.51
TRHR P34981 1/20 0.51

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
SCHEMBL11060360 0.92 LTA4H (0.61) ACEACE2LTA4HTSHR
SCHEMBL30165330 0.88 ACE (0.57) ACEACE2LTA4HTSHR
Oxalic Acid SCHEMBL11058316 0.88 ACE (0.50) ACEOPRM1ACE2
SCHEMBL9508358 0.86 ACE (0.51) ACEOPRM1ACE2LTA4HTSHR
SCHEMBL20375824 0.86 ACE (0.59) ACEOPRM1ACE2
SCHEMBL9508348 0.86 ACE (0.59) ACEOPRM1ACE2
SCHEMBL8250626 0.86 OPRM1 (0.60) ACEOPRM1
SCHEMBL9551626 0.86 ACE (0.66) ACEACE2TSHR
SCHEMBL9509731 0.86 ACE (0.66) ACEACE2TSHR
SCHEMBL5030487 0.85 ACE (0.54) ACEOPRM1ACE2LTA4HTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1359934-B1 TRIPEPTIDES AND TRIPEPTIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NEUROTELL AG (CH) 2006-11-08 EP claimed
US-7129213-B2 Tripeptides and tripeptide derivatives for the treatment of neurodegenerative diseases NEUROTELL AG (CH) 2006-10-31 US claimed
US-7122524-B2 Tripeptides and tripeptide derivatives for the treatment of postlesional disease of the nervous system NEUROTELL AG (CH) 2006-10-17 US claimed
US-20050101538-A1 Tripeptides and tripeptide derivatives for the treatment of neurodegenerative diseases NEUROTELL AG (CH) 2005-05-12 US claimed
US-20050080016-A1 Tripeptides and tripeptide derivatives for the treatment of postlesional diseases of the nervous system NEUROTELL AG (CH) 2005-04-14 US claimed
EP-1363656-B1 TRIPEPTIDES AND TRIPEPTIDE DERIVATIVES FOR THE TREATMENT OF POSTLESIONAL DISEASES OF THE NERVOUS SYSTEM NEUROTELL AG (CH) 2004-12-22 EP claimed
EP-1359934-B1 TRIPEPTIDES AND TRIPEPTIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NEUROTELL AG (CH) 2006-11-08 EP disclosed
US-7129213-B2 Tripeptides and tripeptide derivatives for the treatment of neurodegenerative diseases NEUROTELL AG (CH) 2006-10-31 US disclosed
US-7122524-B2 Tripeptides and tripeptide derivatives for the treatment of postlesional disease of the nervous system NEUROTELL AG (CH) 2006-10-17 US disclosed
US-20050101538-A1 Tripeptides and tripeptide derivatives for the treatment of neurodegenerative diseases NEUROTELL AG (CH) 2005-05-12 US disclosed
US-20050080016-A1 Tripeptides and tripeptide derivatives for the treatment of postlesional diseases of the nervous system NEUROTELL AG (CH) 2005-04-14 US disclosed
EP-1363656-B1 TRIPEPTIDES AND TRIPEPTIDE DERIVATIVES FOR THE TREATMENT OF POSTLESIONAL DISEASES OF THE NERVOUS SYSTEM NEUROTELL AG (CH) 2004-12-22 EP disclosed
EP-1363656-A2 TRIPEPTIDES AND TRIPEPTIDE DERIVATIVES FOR THE TREATMENT OF POSTLESIONAL DISEASES OF THE NERVOUS SYSTEM Neurotell AG (CH) 2003-11-26 EP disclosed
WO-2002062373-A2 TRIPEPTIDES AND TRIPEPTIDE DERIVATIVES FOR THE TREATMENT OF POSTLESIONAL DISEASES OF THE NERVOUS SYSTEM NEUROTELL AG (CH) 2002-08-15 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 (2 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-20050101538-A1 Tripeptides and tripeptide derivatives for the treatment of neurodegenerative diseases HTT, ARGLU1, SLC1A5 ACE 994/4885OPRM1 812/4885ACE2 1055/4885
US-20050080016-A1 Tripeptides and tripeptide derivatives for the treatment of postlesional diseases of the nervous system NPY5R, VIP, ARGLU1 ACE 599/4885OPRM1 810/4885ACE2 708/4885

“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.