SCHEMBL31433295

SCHEMBL31433295

CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 9/20 0.58
▸ NPY4R P50391 9/20 0.58
▸ NPY1R P25929 8/20 0.58
▸ NPY2R P49146 6/20 0.54
▸ NPBWR1 P48145 10/20 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
SCHEMBL31433281 0.92 NPY5R (0.51) NPY5RNPY4RNPY1RNPY2RNPBWR1
SCHEMBL31433466 0.88 NPBWR1 (0.51) NPY5RNPY4RNPY1RNPBWR1
SCHEMBL7464387 0.85 NPY4R (0.58) NPY5RNPY4RNPY1RNPY2RNPBWR1
SCHEMBL31694507 0.83 NPY4R (0.51) NPY5RNPY4RNPY1RNPY2RNPBWR1
SCHEMBL31433308 0.82 IL23R (0.50) NPY4RNPY1RNPY2R
SCHEMBL30445792 0.82 TFPI (0.53) NPY4RNPY1RNPY2RNPBWR1
SCHEMBL31114987 0.82 NPY4R (0.56) NPY5RNPY4RNPY1RNPY2RNPBWR1
SCHEMBL31114992 0.81 NPY4R (0.64) NPY5RNPY4RNPY1RNPY2R
SCHEMBL31114991 0.81 NPY4R (0.59) NPY5RNPY4RNPY1RNPY2RNPBWR1
SCHEMBL30445796 0.81 BACE1 (0.54) NPY5RNPY4RNPY1RNPY2RNPBWR1

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 NPY5R 3645/4885NPY4R 1616/4885NPY1R 2353/4885

“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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