SCHEMBL30799641

SCHEMBL30799641

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.64
BACE1 P56817 16/20 0.64
CTSD P07339 1/20 0.58
BACE2 Q9Y5Z0 2/20 0.57

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
SCHEMBL30799543 1.00 PTPN1 (0.64) PTPN1BACE1CTSDBACE2
SCHEMBL30799743 0.97 BACE1 (0.68) PTPN1BACE1CTSDBACE2
SCHEMBL30799664 0.96 PTPN1 (0.61) PTPN1BACE1CTSD
SCHEMBL30799677 0.96 PTPN1 (0.61) PTPN1BACE1CTSDBACE2
SCHEMBL30799827 0.95 PTPN1 (0.66) PTPN1BACE1CTSDBACE2
SCHEMBL30799370 0.95 PTPN1 (0.66) PTPN1BACE1CTSDBACE2
SCHEMBL30567799 0.95 BACE1 (0.59) PTPN1BACE1CTSDBACE2
SCHEMBL30799623 0.95 PTPN1 (0.59) PTPN1BACE1CTSDBACE2
SCHEMBL30799892 0.94 BACE1 (0.69) PTPN1BACE1CTSDBACE2
SCHEMBL30799532 0.94 BACE1 (0.61) PTPN1BACE1CTSDBACE2

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 PTPN1 2414/4885BACE1 10/4885CTSD 2704/4885

“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.