SCHEMBL30799583

SCHEMBL30799583

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

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 12/20 0.54
ACE P12821 6/20 0.54
MME P08473 4/20 0.54
CPA1 P15085 4/20 0.54
ACE2 Q9BYF1 4/20 0.54
CTSD P07339 1/20 0.47

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
SCHEMBL29846520 0.96 ACE (0.58) BACE1ACEMMECPA1ACE2
SCHEMBL29850820 0.95 ACE (0.57) BACE1ACEMMECPA1ACE2
SCHEMBL31514336 0.92 BACE1 (0.51) BACE1ACEMMECPA1ACE2
SCHEMBL30713700 0.91 ACE (0.61) BACE1ACEMMECPA1ACE2
SCHEMBL30051286 0.90 ACE (0.65) ACEMMECPA1ACE2
SCHEMBL30799476 0.88 BACE1 (0.59) BACE1CTSD
SCHEMBL30799933 0.88 BACE1 (0.54) BACE1CTSD
SCHEMBL30051194 0.88 MME (0.58) ACEMMECPA1ACE2
SCHEMBL30051600 0.88 ACE (0.68) ACEMMECPA1ACE2
SCHEMBL30799521 0.87 BACE1 (0.58) BACE1CTSD

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 BACE1 10/4885ACE 736/4885MME 467/4885

“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.