SCHEMBL30584177

SCHEMBL30584177

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CN)C(=O)N1CCC[C@H]1C(=O)NC(C)(C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AGTR2 P50052 3/20 0.54
▸ AGTR1 P30556 2/20 0.54
▸ NTSR1 P30989 12/20 0.53
▸ NTSR2 O95665 10/20 0.53
▸ NPY1R P25929 1/20 0.52
▸ NPY2R P49146 1/20 0.52
▸ NPY4R P50391 1/20 0.52
▸ NPY5R Q15761 1/20 0.52
▸ SORT1 Q99523 8/20 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
SCHEMBL30584173 0.96 NTSR1 (0.53) AGTR2AGTR1NTSR1NTSR2NPY1R
SCHEMBL30584175 0.91 NTSR1 (0.52) AGTR2AGTR1NTSR1NTSR2NPY1R
SCHEMBL30584174 0.90 NTSR1 (0.66) NTSR1NTSR2SORT1
SCHEMBL30584172 0.89 NPY1R (0.59) NTSR1NTSR2NPY1RNPY2RNPY4R
SCHEMBL30584178 0.89 NTSR1 (0.59) NTSR1NTSR2NPY1RNPY2RNPY4R
SCHEMBL30584176 0.86 NTSR1 (0.66) NTSR1NTSR2SORT1
SCHEMBL30584171 0.86 NTSR1 (0.60) NTSR1NTSR2NPY1RNPY2RNPY4R
SCHEMBL30584170 0.85 NTSR1 (0.59) NTSR1NTSR2NPY1RNPY2RNPY4R
SCHEMBL29496659 0.83 NTSR1 (0.56) AGTR2AGTR1NTSR1NTSR2NPY1R
SCHEMBL31556390 0.82 NTSR1 (0.56) AGTR2AGTR1NTSR1NTSR2NPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265124-A1 OXYTOCIN ANALOGUES AND METHODS FOR USING THE SAME ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2023-08-24 — — 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-20230265124-A1 OXYTOCIN ANALOGUES AND METHODS FOR USING THE SAME OXTR, AVPR2, ADM2 AGTR2 136/4885AGTR1 230/4885NTSR1 510/4885

“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.

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