SCHEMBL18672640

SCHEMBL18672640

CCOC(=O)[C@H](C)CC(Cc1ccc(-c2ccccc2)cc1)NC(=O)c1n[nH]c(=O)o1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MMEL1 Q495T6 4/20 0.57
▸ MME P08473 18/20 0.54
▸ ACE P12821 1/20 0.47

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
SCHEMBL7882839 1.00 MMEL1 (0.57) MMEL1MMEACE
SCHEMBL18672551 0.91 MMEL1 (0.70) MMEL1MMEACE
SCHEMBL12317342 0.91 MMEL1 (0.70) MMEL1MMEACE
SCHEMBL16852174 0.89 MME (0.63) MMEL1MMEACE
SCHEMBL2706220 0.89 MME (0.63) MMEL1MMEACE
SCHEMBL18672745 0.89 MME (0.63) MMEL1MMEACE
SCHEMBL12317403 0.84 MME (0.70) MMEL1MMEACE
SCHEMBL12317341 0.83 MME (0.55) MMEL1MMEACE
SCHEMBL18672658 0.83 MME (0.55) MMEL1MMEACE
SCHEMBL12317404 0.82 MME (0.53) 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 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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