SCHEMBL21098596

SCHEMBL21098596

CCOC(=O)[C@H](C)C[C@@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)CCCC(=O)O

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MME P08473 11/20 0.67
ACE P12821 7/20 0.67
MMEL1 Q495T6 2/20 0.56

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
Sacubitril SCHEMBL18059569 0.94 MME (0.77) MMEACEMMEL1
Sacubitril SCHEMBL489040 0.94 MME (0.77) MMEACEMMEL1
Sacubitril SCHEMBL22420467 0.94 MME (0.77) MMEACEMMEL1
Sacubitril SCHEMBL2707112 0.94 MME (0.77) MMEACEMMEL1
Sacubitril SCHEMBL18574632 0.94 MME (0.77) MMEACEMMEL1
Sacubitril SCHEMBL18059568 0.94 MME (0.77) MMEACEMMEL1
Sacubitril SCHEMBL1908525 0.94 MME (0.77) MMEACEMMEL1
Sacubitril SCHEMBL8214132 0.94 MME (0.77) MMEACEMMEL1
Sacubitril SCHEMBL21239955 0.93 MME (0.76) MMEACEMMEL1
Sacubitril SCHEMBL21239958 0.93 MME (0.76) MMEACEMMEL1

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-3218351-B1 A METHOD FOR THE PREPARATION, ISOLATION AND PURIFICATION OF PHARMACEUTICALLY APPLICABLE FORMS OF AHU-377 ZENTIVA KS (CZ) 2019-06-19 EP disclosed