SCHEMBL18672773

SCHEMBL18672773

C[C@H](CC(Cc1ccc(-c2cccc(Cl)c2)cc1)NC(=O)c1ccc(C(O)O)[nH]1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 19/20 0.67
▸ MMEL1 Q495T6 5/20 0.65
▸ ACE P12821 8/20 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
SCHEMBL18672696 0.90 MME (0.74) MMEMMEL1ACE
SCHEMBL12317421 0.90 MME (0.74) MMEMMEL1ACE
SCHEMBL12317451 0.90 MME (0.74) MMEMMEL1ACE
SCHEMBL18672772 0.82 MME (0.82) MMEMMEL1ACE
SCHEMBL18672719 0.82 MME (0.88) MMEMMEL1
SCHEMBL3707939 0.82 MME (0.88) MMEMMEL1
SCHEMBL12317448 0.82 MME (0.88) MMEMMEL1
SCHEMBL18672724 0.82 MME (0.88) MMEMMEL1
SCHEMBL18672764 0.80 MME (0.61) MMEMMEL1ACE
SCHEMBL12317384 0.80 MME (0.61) MMEMMEL1ACE

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
US-9603819-B2 Substituted aminobutyric derivatives as neprilysin inhibitors NOVARTIS AG (CH) 2017-03-28 — — US disclosed
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