SCHEMBL30799748

SCHEMBL30799748

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

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 11/20 0.56
REN P00797 1/20 0.53
OPRD1 P41143 6/20 0.51
CCKAR P32238 3/20 0.51
CCKBR P32239 3/20 0.51
BACE2 Q9Y5Z0 2/20 0.51
CTSD P07339 1/20 0.51
PTPN1 P18031 1/20 0.49
OPRM1 P35372 2/20 0.49

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
SCHEMBL30799924 0.93 BACE1 (0.60) BACE1BACE2CTSDPTPN1
SCHEMBL30799965 0.92 BACE1 (0.61) BACE1OPRD1BACE2CTSDPTPN1
SCHEMBL30799478 0.90 BACE1 (0.66) BACE1BACE2CTSDPTPN1
SCHEMBL30799955 0.90 BACE1 (0.57) BACE1BACE2CTSDPTPN1
SCHEMBL30799799 0.90 BACE1 (0.66) BACE1BACE2CTSDPTPN1
SCHEMBL30799539 0.90 BACE1 (0.64) BACE1OPRD1BACE2CTSDPTPN1
SCHEMBL30799734 0.90 BACE1 (0.58) BACE1OPRD1BACE2CTSDOPRM1
SCHEMBL30799650 0.89 OPRD1 (0.55) BACE1RENOPRD1CCKARCCKBR
SCHEMBL31612153 0.88 BACE1 (0.55) BACE1BACE2CTSD
SCHEMBL29447711 0.88 BACE1 (0.55) BACE1BACE2CTSD

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 10/4885REN 818/4885OPRD1 4412/4885

“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.