SCHEMBL19190564

SCHEMBL19190564

CN[C@H](Cc1ccc(-c2cccc(Cl)c2)cc1)CC(O)C(=O)OCOC(=O)[C@@H](NC(=O)OC)C(C)C

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 17/20 0.58
▸ ACE P12821 7/20 0.58
▸ MMEL1 Q495T6 6/20 0.48

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
SCHEMBL14902429 0.91 MME (0.72) MMEACEMMEL1
SCHEMBL18597756 0.91 MME (0.72) MMEACEMMEL1
SCHEMBL19690456 0.84 MME (0.63) MMEACEMMEL1
SCHEMBL18724941 0.84 MME (0.63) MMEACEMMEL1
SCHEMBL19840282 0.84 MME (0.63) MMEACEMMEL1
SCHEMBL17011360 0.84 MME (0.63) MMEACEMMEL1
SCHEMBL19708727 0.83 MME (0.64) MMEACEMMEL1
SCHEMBL19708546 0.82 MME (0.48) MMEACEMMEL1
SCHEMBL18724833 0.82 MME (0.59) MMEACEMMEL1
SCHEMBL17011370 0.82 MME (0.59) 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-3199517-A1 NEPRILYSIN INHIBITORS Theravance Biopharma R&D IP, LLC (US) 2017-08-02 — — EP disclosed
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