SCHEMBL29648960

SCHEMBL29648960

N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP3 Q9NY33 5/20 0.69
OPRM1 P35372 2/20 0.59
OPRD1 P41143 1/20 0.59
OPRK1 P41145 1/20 0.59
NTSR2 O95665 1/20 0.56
NTSR1 P30989 1/20 0.56
SORT1 Q99523 1/20 0.56

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
SCHEMBL30610091 1.00 DPP3 (0.69) DPP3OPRM1OPRD1OPRK1NTSR2
SCHEMBL29974089 0.97 DPP3 (0.66) DPP3OPRM1OPRD1OPRK1
SCHEMBL29772686 0.96 DPP3 (0.65) DPP3OPRM1
SCHEMBL29577213 0.96 DPP3 (0.65) DPP3OPRM1
SCHEMBL30050936 0.96 DPP3 (0.69) DPP3OPRM1
SCHEMBL31072081 0.95 DPP3 (0.68) DPP3OPRM1NTSR2NTSR1SORT1
SCHEMBL29963309 0.95 DPP3 (0.64) DPP3OPRM1NTSR2NTSR1SORT1
SCHEMBL30052255 0.94 DPP3 (0.69) DPP3OPRM1OPRD1OPRK1
SCHEMBL30957019 0.93 DPP3 (0.61) DPP3OPRM1OPRD1OPRK1NTSR2
SCHEMBL29842186 0.92 DPP3 (0.65) DPP3NTSR2NTSR1SORT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110430889-B Macrocyclic peptides that reduce C-MYC protein levels and slow cancer cell growth 堪萨斯大学 2023-09-19 CN claimed
CN-110430889-B Macrocyclic peptides that reduce C-MYC protein levels and slow cancer cell growth 堪萨斯大学 2023-09-19 CN disclosed
CN-110430889-B Macrocyclic peptides that reduce C-MYC protein levels and slow cancer cell growth 堪萨斯大学 2023-09-19 CN disclosed
US-11325944-B2 Macrocyclic peptides and derivatives thereof with opioid activity UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2022-05-10 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 (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-11325944-B2 Macrocyclic peptides and derivatives thereof with opioid activity OPRL1, OPRM1, OPRK1 DPP3 333/4885OPRM1 2/4885OPRD1 5/4885

“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.