SCHEMBL24178180

SCHEMBL24178180

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

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 7/20 0.44
▸ NPY4R P50391 10/20 0.43
▸ NPY1R P25929 8/20 0.43
▸ NPY5R Q15761 7/20 0.43
▸ NPY2R P49146 4/20 0.43
▸ CTSD P07339 6/20 0.42

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
SCHEMBL24178182 1.00 BACE1 (0.44) BACE1NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL583830 0.92 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL13933715 0.92 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL4669504 0.92 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL11021602 0.92 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
SCHEMBL24178267 0.91 SIRT5 (0.38) BACE1NPY4RNPY1RNPY5RNPY2R
Leupeptin SCHEMBL11596919 0.91 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2R
SCHEMBL3308386 0.91 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30643187 0.91 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2R
SCHEMBL16316642 0.87 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912742-B2 Heterologous production of leupeptin protease inhibitors and analogs thereof YALE UNIVERSITY (US) 2024-02-27 — — US disclosed
US-20220002354-A1 HETEROLOGOUS PRODUCTION OF LEUPEPTIN PROTEASE INHIBITORS AND ANALOGS THEREOF YALE UNIVERSITY 2022-01-06 — — 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 (2 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-11912742-B2 Heterologous production of leupeptin protease inhibitors and analogs thereof LPXN, LAP3, PEPD BACE1 1992/4885NPY4R 2718/4885NPY1R 2805/4885
US-20220002354-A1 HETEROLOGOUS PRODUCTION OF LEUPEPTIN PROTEASE INHIBITORS AND ANALOGS THEREOF LPXN, LAP3, PEPD BACE1 1992/4885NPY4R 2718/4885NPY1R 2805/4885

“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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