SCHEMBL30444760

SCHEMBL30444760

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)NCC(N)=O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 4/20 0.51
▸ OPRD1 P41143 5/20 0.51
▸ OXTR P30559 1/20 0.51
▸ OPRM1 P35372 1/20 0.49
▸ OPRK1 P41145 1/20 0.49
▸ HCRTR1 O43613 1/20 0.49
▸ HCRTR2 O43614 1/20 0.49
▸ NTSR1 P30989 3/20 0.48
▸ NTSR2 O95665 1/20 0.48
▸ SORT1 Q99523 1/20 0.48

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
SCHEMBL30445290 0.84 OPRD1 (0.59) CALCROPRD1OPRM1OPRK1NTSR1
SCHEMBL29420248 0.82 NPY1R (0.62) OPRD1NTSR1NTSR2SORT1
SCHEMBL14060698 0.82 NPY1R (0.55) CALCROPRD1OPRM1NTSR1NTSR2
SCHEMBL30423827 0.81 NMUR2 (0.57) OPRD1OPRM1
SCHEMBL15512342 0.81 OPRD1 (0.52) CALCROPRD1OXTRNTSR1
SCHEMBL29611985 0.81 NPY1R (0.62) OPRD1NTSR1NTSR2SORT1
SCHEMBL29612065 0.81 NPY1R (0.62) OPRD1NTSR1NTSR2SORT1
SCHEMBL29612082 0.81 NPY1R (0.62) OPRD1NTSR1NTSR2SORT1
SCHEMBL20707335 0.81 NPY1R (0.62) OPRD1NTSR1NTSR2SORT1
SCHEMBL29611692 0.81 NPY1R (0.62) OPRD1NTSR1NTSR2SORT1

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-20230173076-A1 METABOLICALLY STABLE PEPTIDE ANALOGS UNIV STRASBOURG (FR) 2023-06-08 — — 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-20230173076-A1 METABOLICALLY STABLE PEPTIDE ANALOGS GPR119, GLP1R, GIPR CALCR 191/4885OPRD1 995/4885OXTR 990/4885

“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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