SCHEMBL16315715

SCHEMBL16315715

CC(=O)C(=O)[C@@H]1CCCCCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N2C[C@H]3[C@@H]([C@H]2C(=O)N1)C3(C)C

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.35
▸ F2 P00734 1/20 0.33
▸ F10 P00742 1/20 0.33
▸ PRSS1 P07477 1/20 0.33
▸ BACE1 P56817 3/20 0.32
▸ PLG P00747 1/20 0.31

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
SCHEMBL16349734 1.00 GAA (0.35) GAAF2F10PRSS1BACE1
SCHEMBL16349581 1.00 GAA (0.35) GAAF2F10PRSS1BACE1
SCHEMBL8290298 0.94 F2 (0.34) GAAF2F10PRSS1BACE1
SCHEMBL13685052 0.94 F2 (0.34) GAAF2F10PRSS1BACE1
SCHEMBL7858719 0.94 F2 (0.34) GAAF2F10PRSS1BACE1
SCHEMBL8048356 0.94 F2 (0.34) GAAF2F10PRSS1BACE1
SCHEMBL13685318 0.94 F2 (0.34) GAAF2F10PRSS1BACE1
SCHEMBL16349821 0.92 GAA (0.31) GAAF2F10PRSS1BACE1
SCHEMBL8290536 0.91 GAA (0.33) GAAF2F10PRSS1BACE1
SCHEMBL13685100 0.89 F2 (0.33) GAAF2F10PRSS1BACE1

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-7772178-B2 Pharmaceutical formulations and methods of treatment using the same SCHERING CORPORATION (US) 2010-08-10 — — US disclosed
US-20070021351-A1 Liver/plasma concentration ratio for dosing hepatitis C virus protease inhibitor SCHERING CORPORATION 2007-01-25 — — US disclosed
US-20070010431-A1 Pharmaceutical formulations and methods of treatment using the same SCHERING CORPORATION 2007-01-11 — — US disclosed
US-20070004635-A1 Method of treating interferon non-responders using HCV protease inhibitor SCHERING CORPORATION 2007-01-04 — — 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 (3 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-20070004635-A1 Method of treating interferon non-responders using HCV protease inhibitor IFNAR1, IFNG, IRF3 GAA 26/4885F2 1082/4885F10 922/4885
US-20070021351-A1 Liver/plasma concentration ratio for dosing hepatitis C virus protease inhibitor PYGL, SERPINB1, PREP GAA 409/4885F2 69/4885F10 385/4885
US-20070010431-A1 Pharmaceutical formulations and methods of treatment using the same LPXN, SLC5A11, F12 GAA 720/4885F2 575/4885F10 109/4885

“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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