SCHEMBL18672747

SCHEMBL18672747

C[C@H](CC(Cc1ccc(-c2ccccc2)cc1)NC(=O)c1n[nH]c(=O)[nH]1)C(=O)O

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 13/20 0.79
▸ MMEL1 Q495T6 6/20 0.65
▸ ACE P12821 2/20 0.61

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
SCHEMBL12317336 1.00 MME (0.79) MMEMMEL1ACE
SCHEMBL17667996 1.00 MME (0.79) MMEMMEL1ACE
SCHEMBL12317403 0.90 MME (0.70) MMEMMEL1ACE
SCHEMBL2873059 0.84 MME (0.74) MMEMMEL1
SCHEMBL10198029 0.84 MME (0.66) MMEMMEL1ACE
SCHEMBL18672751 0.84 MME (0.66) MMEMMEL1ACE
SCHEMBL17667995 0.84 MME (0.66) MMEMMEL1ACE
SCHEMBL6128164 0.83 MMEL1 (0.68) MMEMMEL1ACE
SCHEMBL3700012 0.83 MMEL1 (0.68) MMEMMEL1ACE
SCHEMBL12317308 0.82 MME (0.79) 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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