SCHEMBL1728385

SCHEMBL1728385

COC(=O)O[C@@H]1CS[C@H]2C[C@@](CC(C)C)(NC(=O)OC(C)(C)C)C(=O)N21

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.35
GFER P55789 1/20 0.31
PPIA P62937 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
SCHEMBL1728242 1.00 DPP4 (0.35) DPP4GFERPPIA
SCHEMBL1728832 1.00 DPP4 (0.35) DPP4GFERPPIA
SCHEMBL1730740 0.91 DPP4 (0.36) DPP4GFER
SCHEMBL1730098 0.90 PPIA (0.32) GFERPPIA
SCHEMBL1728447 0.86 PPIA (0.30) GFERPPIA
SCHEMBL5770627 0.86 PPIA (0.30) GFERPPIA
SCHEMBL1729814 0.86 PPIA (0.30) GFERPPIA
SCHEMBL1728337 0.86 PPIA (0.30) GFERPPIA
SCHEMBL6474079 0.85 DPP4 (0.35) DPP4GFERPPIA
SCHEMBL6479927 0.85 DPP4 (0.35) DPP4GFERPPIA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651653-B1 NOVEL CYANO THIAZOLIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT SANOFI AVENTIS DEUTSCHLAND (DE) 2011-11-23 EP disclosed
EP-1651653-A1 NOVEL CYANO THIAZOLIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT Sanofi-Aventis Deutschland GmbH (DE) 2006-05-03 EP disclosed
WO-2005012312-A1 NOVEL CYANO THIAZOLIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-02-10 WO disclosed