SCHEMBL18800965

SCHEMBL18800965

CCC(=O)C(=O)N[C@H](Cc1ccc(-c2cccc(Cl)c2)cc1)CC(O)C=O

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 16/20 0.61
▸ ACE P12821 8/20 0.61
▸ MMEL1 Q495T6 7/20 0.54

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
SCHEMBL16008239 0.88 MME (0.80) MMEACEMMEL1
SCHEMBL18598043 0.85 MME (0.79) MMEACEMMEL1
SCHEMBL16270268 0.84 MME (0.69) MMEACEMMEL1
SCHEMBL16008124 0.78 MME (0.77) MMEACEMMEL1
SCHEMBL16011808 0.78 MME (0.77) MMEACEMMEL1
SCHEMBL16011679 0.76 MME (0.78) MMEACEMMEL1
SCHEMBL16008688 0.76 MME (0.78) MMEACEMMEL1
SCHEMBL14890447 0.76 MME (1.00) MMEACEMMEL1
SCHEMBL18597868 0.76 MME (1.00) MMEACEMMEL1
SCHEMBL14890588 0.75 MME (0.70) 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
EP-2964616-B1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP LLC (US) 2017-05-03 — — EP disclosed
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