SCHEMBL30799679

SCHEMBL30799679

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

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 3/20 0.56
LTA4H P09960 3/20 0.56
MME P08473 2/20 0.56
ACE P12821 6/20 0.52
ANPEP P15144 1/20 0.52
ECE1 P42892 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
SCHEMBL2548267 0.97 CTRB1 (0.58) CTRB1LTA4HMMEACEANPEP
SCHEMBL30799883 0.95 MME (0.56) CTRB1MMEACE
SCHEMBL11799997 0.95 MME (0.56) CTRB1MMEACE
SCHEMBL10646220 0.92 MME (0.58) CTRB1MMEACE
SCHEMBL29470194 0.92 MME (0.58) CTRB1MMEACE
SCHEMBL29531510 0.92 MME (0.58) CTRB1MMEACE
SCHEMBL10646215 0.92 MME (0.58) CTRB1MMEACE
SCHEMBL30799731 0.91 MME (0.55) CTRB1MMEACE
SCHEMBL30799461 0.91 MME (0.54) CTRB1MMEACE
SCHEMBL11800074 0.91 OPRD1 (0.60) LTA4HMME

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 CTRB1 2805/4885LTA4H 4132/4885MME 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.