SCHEMBL29865950

SCHEMBL29865950

COC(=O)[C@H](CC(C)C)N1CC[C@H](NC(=O)OC(C)(C)C)C1=O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.38
F2 P00734 1/20 0.38
F10 P00742 1/20 0.38
PRSS1 P07477 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
CTSK P43235 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
ITGB3 P05106 2/20 0.36
ITGA2B P08514 2/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL3470249 0.90 MME (0.41) GAAF2F10PRSS1CTSK
SCHEMBL24403220 0.90 MME (0.41) GAAF2F10PRSS1CTSK
SCHEMBL13928417 0.90 MME (0.41) GAAF2F10PRSS1CTSK
SCHEMBL29866112 0.86 F2 (0.35) GAAF2F10PRSS1CTSK
SCHEMBL6564073 0.84 GAA (0.42) GAAF2F10PRSS1CTSK
SCHEMBL29866132 0.82 GAA (0.38) GAAF2F10PRSS1MEN1
SCHEMBL10264443 0.81 GAA (0.46) GAAF2F10PRSS1CTSK
SCHEMBL325216 0.81 GAA (0.46) GAAF2F10PRSS1CTSK
SCHEMBL22648647 0.81 GAA (0.38) GAAF2F10PRSS1KMT2A
SCHEMBL5936027 0.81 GAA (0.39) GAAF2F10PRSS1KMT2A

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-20220324800-A1 SARS-3CL PROTEASE INHIBITORS Primmune Therapeutics, Inc. 2022-10-13 US disclosed
WO-2022212707-A1 SARS-3CL PROTEASE INHIBITORS Primmune Therapeutics, Inc. (US) 2022-10-06 WO 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-20220324800-A1 SARS-3CL PROTEASE INHIBITORS ACE, ACE2, SARS1 GAA 355/4885F2 925/4885F10 3746/4885

“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.