SCHEMBL18672582

SCHEMBL18672582

CCCCC(CC(=O)NC(Cc1ccc(-c2ccccc2)cc1)C[C@@H](C)C(=O)O)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 12/20 0.64
▸ ACE P12821 5/20 0.64
▸ MMEL1 Q495T6 5/20 0.64

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
SCHEMBL12317228 1.00 MME (0.64) MMEACEMMEL1
SCHEMBL17745135 0.86 MME (0.60) MMEACEMMEL1
SCHEMBL12317230 0.86 MME (0.60) MMEACEMMEL1
SCHEMBL18672518 0.86 MME (0.60) MMEACEMMEL1
SCHEMBL18672812 0.86 MME (0.60) MMEACEMMEL1
SCHEMBL10197932 0.86 MME (0.60) MMEACEMMEL1
SCHEMBL18672611 0.85 MME (0.77) MMEACEMMEL1
SCHEMBL8552272 0.85 MME (0.77) MMEACEMMEL1
SCHEMBL9565425 0.82 MME (0.72) MMEACEMMEL1
SCHEMBL9565409 0.81 MME (0.81) MMEACEMMEL1

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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