SCHEMBL14959401

SCHEMBL14959401

CCOC(=O)CC(Cc1ccc(-c2cccc(Cl)c2)cc1)NC(=O)CNC(=O)OCC

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMEL1 Q495T6 11/20 0.67
MME P08473 11/20 0.56
ACE P12821 6/20 0.50

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
SCHEMBL8579481 1.00 MMEL1 (0.67) MMEL1MMEACE
SCHEMBL2877479 0.92 MMEL1 (0.72) MMEL1MMEACE
SCHEMBL2877483 0.92 MMEL1 (0.72) MMEL1MMEACE
SCHEMBL8552535 0.86 MMEL1 (0.67) MMEL1MMEACE
SCHEMBL1912538 0.85 MMEL1 (0.79) MMEL1MMEACE
SCHEMBL12975326 0.85 MMEL1 (0.73) MMEL1MMEACE
SCHEMBL1912542 0.85 MMEL1 (0.79) MMEL1MMEACE
SCHEMBL1912639 0.85 MMEL1 (0.78) MMEL1MMEACE
SCHEMBL1912636 0.85 MMEL1 (0.78) MMEL1MMEACE
SCHEMBL10198457 0.84 MMEL1 (0.66) MMEL1MMEACE

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-2594557-B1 Substituted aminopropionic derivatives as neprilysin inhibitors NOVARTIS AG (CH) 2016-08-10 EP disclosed
EP-2594556-A1 Substituted aminopropionic derivatives as neprilysin inhibitors Novartis AG (CH) 2013-05-22 EP disclosed
EP-2594557-A1 Substituted aminopropionic derivatives as neprilysin inhibitors Novartis AG (CH) 2013-05-22 EP disclosed