SCHEMBL29894779

SCHEMBL29894779

C[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 10/20 0.46
▸ ACE P12821 5/20 0.43
▸ CPA1 P15085 1/20 0.43
▸ ACE2 Q9BYF1 1/20 0.43
▸ OPRM1 P35372 1/20 0.41
▸ OPRD1 P41143 1/20 0.41

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
SCHEMBL29894761 0.92 OPRD1 (0.42) MMEACECPA1ACE2OPRM1
SCHEMBL30123072 0.92 OPRD1 (0.44) MMEOPRM1OPRD1
SCHEMBL29895454 0.92 ENPEP (0.43) MMEACECPA1ACE2OPRM1
SCHEMBL30116291 0.89 MME (0.38) MMEACE
SCHEMBL29384990 0.87 ACE (0.38) MMEACE
SCHEMBL29531471 0.86 ACE (0.47) MMEACECPA1ACE2OPRD1
SCHEMBL31256968 0.86 OPRD1 (0.46) MMEACEOPRM1OPRD1
SCHEMBL29615620 0.85 ACE (0.48) MMEACECPA1ACE2OPRD1
SCHEMBL29961809 0.85 MME (0.45) MMEACECPA1ACE2
SCHEMBL31274737 0.84 MME (0.50) MMEACEOPRD1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212216-A1 SYNTHESIS OF LACTONE DERIVATIVES AND THEIR USE IN THE MODIFICATION OF PROTEINS GENIE BIOTECH UK LTD. (GB) 2023-07-06 — — US claimed
EP-4076533-A1 SYNTHESIS OF LACTONE DERIVATIVES AND THEIR USE IN THE MODIFICATION OF PROTEINS GENIE BIOTECH UK LTD. (GB) 2022-10-26 — — EP claimed
US-20230212216-A1 SYNTHESIS OF LACTONE DERIVATIVES AND THEIR USE IN THE MODIFICATION OF PROTEINS GENIE BIOTECH UK LTD. (GB) 2023-07-06 — — US disclosed
EP-4076533-A1 SYNTHESIS OF LACTONE DERIVATIVES AND THEIR USE IN THE MODIFICATION OF PROTEINS GENIE BIOTECH UK LTD. (GB) 2022-10-26 — — EP 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-20230212216-A1 SYNTHESIS OF LACTONE DERIVATIVES AND THEIR USE IN THE MODIFICATION OF PROTEINS AGL, PGLS, DDOST MME 3931/4885ACE 3445/4885CPA1 2917/4885

“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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