SCHEMBL1729957

SCHEMBL1729957

COC(=O)O[C@@H]1CS[C@H]2C[C@@](CN3CCCCC3)(NC(=O)OC(C)(C)C)C(=O)N21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPIA P62937 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL1730098 0.87 PPIA (0.32) PPIA
SCHEMBL1728242 0.85 DPP4 (0.35) PPIA
SCHEMBL1728385 0.85 DPP4 (0.35) PPIA
SCHEMBL1728832 0.85 DPP4 (0.35) PPIA
SCHEMBL6063221 0.84 L3MBTL1 (0.31) PPIAL3MBTL1
SCHEMBL1729814 0.83 PPIA (0.30) PPIA
SCHEMBL1728337 0.83 PPIA (0.30) PPIA
SCHEMBL5770627 0.83 PPIA (0.30) PPIA
SCHEMBL1728447 0.83 PPIA (0.30) PPIA
SCHEMBL1730373 0.81 PPIA (0.41) PPIAL3MBTL1

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
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