SCHEMBL30799643

SCHEMBL30799643

NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccsc1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.48
ECE1 P42892 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
SCHEMBL30799784 0.90 GHSR (0.57) GHSR
SCHEMBL30799645 0.87 ECE1 (0.51) GHSRECE1
SCHEMBL30799428 0.84 GHSR (0.52) GHSRECE1
SCHEMBL30958546 0.84 LTA4H (0.58) GHSRECE1
SCHEMBL30506402 0.84 LTA4H (0.58) GHSRECE1
SCHEMBL31171028 0.83 GHSR (0.58) GHSRECE1
SCHEMBL31259940 0.83 ACE (0.57) ECE1
SCHEMBL31259935 0.83 ACE (0.57) ECE1
SCHEMBL31259937 0.83 ACE (0.57) ECE1
SCHEMBL31259936 0.83 ACE (0.57) ECE1

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 GHSR 1194/4885ECE1 1922/4885

“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.