SCHEMBL30799746

SCHEMBL30799746

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

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSC P53634 1/20 0.53
SLC15A1 P46059 1/20 0.50
CTSL P07711 1/20 0.49
ALPI P09923 1/20 0.49
PKM P14618 1/20 0.49
PTGS1 P23219 1/20 0.49
XIAP P98170 1/20 0.49
SLC7A5 Q01650 1/20 0.49
LTA4H P09960 1/20 0.48
MC4R P32245 1/20 0.46
MC3R P41968 1/20 0.46
MME P08473 1/20 0.46
ECE1 P42892 1/20 0.46
IL1RN P18510 1/20 0.46
ERAP2 Q6P179 1/20 0.46
ERAP1 Q9NZ08 1/20 0.46
FCER2 P06734 1/20 0.46
OPRK1 P41145 1/20 0.46

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
SCHEMBL30799840 0.96 CTSL (0.55) CTSCCTSL
SCHEMBL30799839 0.93 OPRD1 (0.51) CTSCFCER2OPRK1
SCHEMBL29743321 0.92 NAALAD2 (0.55) CTSCSLC15A1ALPIPKMPTGS1
SCHEMBL2487636 0.92 NAALAD2 (0.55) CTSCSLC15A1ALPIPKMPTGS1
SCHEMBL5970501 0.92 NAALAD2 (0.55) CTSCSLC15A1ALPIPKMPTGS1
SCHEMBL31672244 0.92 NAALAD2 (0.55) CTSCSLC15A1ALPIPKMPTGS1
SCHEMBL30799945 0.92 CTSL (0.51) CTSLMME
SCHEMBL30799426 0.91
SCHEMBL29652313 0.88 NAALAD2 (0.54) CTSCALPIPKMPTGS1XIAP
SCHEMBL15765930 0.88 BACE1 (0.53) MME

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 CTSC 732/4885SLC15A1 4744/4885CTSL 1197/4885

“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.