SCHEMBL23312953

SCHEMBL23312953

CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ECE1 P42892 6/20 0.58
▸ GHSR Q92847 4/20 0.57
▸ ACE P12821 2/20 0.55
▸ CTSC P53634 1/20 0.55
▸ MMP9 P14780 4/20 0.53
▸ MMP8 P22894 4/20 0.53
▸ MMP1 P03956 3/20 0.53
▸ MMP3 P08254 2/20 0.53
▸ MMP2 P08253 2/20 0.51

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
SCHEMBL30052328 0.93 ACE (0.60) ECE1ACECTSCMMP9MMP8
SCHEMBL23312954 0.93 ECE1 (0.67) ECE1ACECTSCMMP9MMP8
SCHEMBL7397057 0.91 ACE (0.58) ECE1GHSRACECTSC
SCHEMBL7397063 0.91 ACE (0.58) ECE1GHSRACECTSC
SCHEMBL30051826 0.91 ACE (0.68) ECE1ACE
SCHEMBL29555460 0.89 ACE (0.66) ECE1ACE
SCHEMBL3512696 0.89 ACE (0.71) ECE1ACE
SCHEMBL5481232 0.89 ACE (0.71) ECE1ACE
SCHEMBL8725890 0.89 ACE (0.71) ECE1ACE
SCHEMBL7397641 0.89 ACE (0.71) ECE1ACE

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-10993983-B2 Cyclic peptide epitopes and small-molecule mimics for inducing autophagy TRUSTEES OF TUFTS COLLEGE (US) 2021-05-04 — — 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-10993983-B2 Cyclic peptide epitopes and small-molecule mimics for inducing autophagy BECN1, SQSTM1, ATG7 ECE1 2223/4885GHSR 2345/4885ACE 4349/4885

“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.

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