SCHEMBL31433322

SCHEMBL31433322

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

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 2/20 0.62
▸ LTA4H P09960 1/20 0.59
▸ OPRM1 P35372 1/20 0.53
▸ OPRD1 P41143 1/20 0.53

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
SCHEMBL29532187 0.96 MME (0.60) MMELTA4H
SCHEMBL30799773 0.94 MME (0.58) MMELTA4HOPRM1OPRD1
SCHEMBL30735528 0.91 MME (0.57) MME
SCHEMBL30052482 0.90 MME (0.64) MMELTA4H
SCHEMBL29373701 0.90 BACE1 (0.59) MME
SCHEMBL29459545 0.89 OPRK1 (0.58) MMEOPRM1
SCHEMBL31174325 0.88 MME (0.60) MME
SCHEMBL233445 0.88 MME (0.60) MME
SCHEMBL233444 0.88 MME (0.60) MME
SCHEMBL1864186 0.88 MME (0.60) 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-20250074942-A1 COMPOSITIONS AND METHODS FOR COVALENT PEPTIDE-BASED MODULATORS OF HLA-E CALICO LIFE SCIENCES LLC (US) 2025-03-06 — — 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-20250074942-A1 COMPOSITIONS AND METHODS FOR COVALENT PEPTIDE-BASED MODULATORS OF HLA-E MICA, CD74, HLA-DRB1 MME 130/4885LTA4H 1057/4885OPRM1 2906/4885

“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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