SCHEMBL18672551

SCHEMBL18672551

CCOC(=O)[C@H](C)CC(Cc1ccc(-c2cccc(Cl)c2)cc1)NC(=O)c1n[nH]c(=O)o1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MMEL1 Q495T6 8/20 0.70
▸ MME P08473 14/20 0.58
▸ ACE P12821 3/20 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
SCHEMBL12317342 1.00 MMEL1 (0.70) MMEL1MMEACE
SCHEMBL7882839 0.91 MMEL1 (0.57) MMEL1MMEACE
SCHEMBL18672640 0.91 MMEL1 (0.57) MMEL1MMEACE
SCHEMBL2705198 0.90 MMEL1 (0.77) MMEL1MMEACE
SCHEMBL18672677 0.90 MMEL1 (0.77) MMEL1MMEACE
SCHEMBL2707358 0.90 MMEL1 (0.77) MMEL1MMEACE
SCHEMBL10197731 0.88 MMEL1 (0.78) MMEL1MMEACE
SCHEMBL18672746 0.84 MME (0.56) MMEL1MMEACE
SCHEMBL12317408 0.84 MME (0.56) MMEL1MMEACE
SCHEMBL12317385 0.83 MME (0.81) 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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