SCHEMBL14952856

SCHEMBL14952856

O=C(O)C[C@@H](Cc1ccc(-c2cccc(Cl)c2)cc1)NC(=O)C(F)(F)C(F)(F)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MMEL1 Q495T6 12/20 1.00
▸ MME P08473 10/20 0.67
▸ ACE P12821 3/20 0.57
▸ FFAR2 O15552 1/20 0.55

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
SCHEMBL8530931 1.00 MMEL1 (1.00) MMEL1MMEACEFFAR2
SCHEMBL8530935 0.87 MMEL1 (0.77) MMEL1MMEACE
SCHEMBL15986384 0.87 MMEL1 (0.77) MMEL1MMEACE
SCHEMBL12317454 0.86 MMEL1 (0.75) MMEL1MMEACE
SCHEMBL12317429 0.86 MMEL1 (0.75) MMEL1MMEACE
SCHEMBL18672775 0.86 MMEL1 (0.75) MMEL1MMEACE
SCHEMBL18672548 0.86 MMEL1 (0.75) MMEL1MMEACE
SCHEMBL2877370 0.82 MMEL1 (0.75) MMEL1MMEACE
SCHEMBL12317387 0.82 MMEL1 (0.69) MMEL1MMEACE
SCHEMBL18672766 0.82 MMEL1 (0.69) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8822534-B2 Substituted aminopropionic derivatives as neprilysin inhibitors NOVARTIS AG (CH) 2014-09-02 — — US claimed
EP-2594557-B1 Substituted aminopropionic derivatives as neprilysin inhibitors NOVARTIS AG (CH) 2016-08-10 — — EP disclosed
EP-2640375-B1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2016-05-18 — — EP disclosed
EP-2435409-B1 SUBSTITUTED AMINOPROPIONIC DERIVATIVES AS NEPRILYSIN INHIBITORS NOVARTIS AG (CH) 2014-08-13 — — EP disclosed
EP-2594556-A1 Substituted aminopropionic derivatives as neprilysin inhibitors Novartis AG (CH) 2013-05-22 — — EP disclosed
EP-2594557-A1 Substituted aminopropionic derivatives as neprilysin inhibitors Novartis AG (CH) 2013-05-22 — — EP disclosed
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