SCHEMBL30799678

SCHEMBL30799678

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

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 3/20 0.52
▸ BACE1 P56817 14/20 0.50
▸ BMP1 P13497 1/20 0.46
▸ CTSD P07339 3/20 0.45
▸ GNPAT O15228 1/20 0.44

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
SCHEMBL31751397 0.94 PTPN1 (0.54) PTPN1BACE1CTSD
SCHEMBL30717261 0.94 BACE1 (0.45) PTPN1BACE1BMP1CTSDGNPAT
SCHEMBL3178856 0.92 PTPN1 (0.52) PTPN1BACE1CTSDGNPAT
SCHEMBL22315779 0.92 PTPN1 (0.52) PTPN1BACE1CTSDGNPAT
SCHEMBL3178877 0.92 PTPN1 (0.52) PTPN1BACE1CTSDGNPAT
SCHEMBL30799479 0.92 BACE1 (0.47) PTPN1BACE1BMP1CTSDGNPAT
SCHEMBL29873723 0.91 FOLH1 (0.49) PTPN1BACE1GNPAT
SCHEMBL30799805 0.89 PTPN1 (0.51) PTPN1BACE1BMP1CTSD
SCHEMBL34464998 0.89 DPP4 (0.51) BACE1BMP1CTSD
SCHEMBL29777901 0.89 PTPN1 (0.51) PTPN1BACE1BMP1CTSD

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 10/4885BMP1 142/4885

“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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