SCHEMBL9941372

SCHEMBL9941372

O=C(NC(Cc1ccc(-c2ccccc2)cc1Cl)CC(O)C(=O)O)c1nn(-c2cccc(Cl)c2)c(=O)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 20/20 0.60
▸ ACE P12821 7/20 0.59

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
SCHEMBL9930569 1.00 MME (0.60) MMEACE
SCHEMBL9929744 0.96 MME (0.62) MMEACE
SCHEMBL9929562 0.89 MME (0.73) MMEACE
SCHEMBL9930524 0.88 MME (0.77) MMEACE
SCHEMBL18724775 0.88 MME (0.77) MMEACE
SCHEMBL9941059 0.83 MME (0.65) MMEACE
SCHEMBL9929874 0.83 MME (0.65) MMEACE
SCHEMBL9941377 0.82 MME (0.68) MMEACE
SCHEMBL9929968 0.82 MME (0.68) MMEACE
SCHEMBL18724736 0.80 MME (0.65) MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651896-A1 NEPRILYSIN INHIBITORS Theravance, Inc. (US) 2013-10-23 — — EP disclosed
WO-2012082853-A1 NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2012-06-21 — — WO disclosed
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