SCHEMBL30799632

SCHEMBL30799632

CCCC[C@H](N)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 7/20 0.65
▸ OPRM1 P35372 5/20 0.65
▸ OPRK1 P41145 2/20 0.65
▸ CTSB P07858 1/20 0.54
▸ PSMB5 P28074 2/20 0.52
▸ LTA4H P09960 1/20 0.52

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
SCHEMBL29568486 0.89 OPRM1 (0.57) OPRD1OPRM1OPRK1CTSB
SCHEMBL29569090 0.88 OPRM1 (0.63) OPRD1OPRM1OPRK1
SCHEMBL29892587 0.87 OPRD1 (0.68) OPRD1OPRM1OPRK1CTSB
SCHEMBL30799373 0.87 OPRM1 (0.58) OPRD1OPRM1OPRK1LTA4H
SCHEMBL29568724 0.87 OPRK1 (0.59) OPRD1OPRM1OPRK1CTSB
SCHEMBL29612429 0.87 NPY4R (0.60) OPRD1OPRM1OPRK1PSMB5LTA4H
SCHEMBL7999621 0.87 NPY1R (0.60) LTA4H
SCHEMBL7999628 0.87 NPY1R (0.60) LTA4H
SCHEMBL30799344 0.87 OPRM1 (0.67) OPRD1OPRM1OPRK1CTSBLTA4H
SCHEMBL30799565 0.87 OPRM1 (0.67) OPRD1OPRM1OPRK1CTSBLTA4H

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-20240116985-A1 STAPLED PEPTIDES AND METHODS THEREOF PARABILIS MEDICINES, INC. 2024-04-11 — — 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-20240116985-A1 STAPLED PEPTIDES AND METHODS THEREOF CTNNB1, APC, CTNNA1 OPRD1 4412/4885OPRM1 4382/4885OPRK1 3407/4885

“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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