SCHEMBL18012898

SCHEMBL18012898

CCOC(=O)[C@](C)(CO)C[C@@H](Cc1ccc(-c2cc(Cl)ccc2F)cc1)NC(=O)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 19/20 0.62
▸ ACE P12821 5/20 0.62
▸ MMEL1 Q495T6 1/20 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
SCHEMBL19705881 1.00 MME (0.62) MMEACEMMEL1
SCHEMBL19771841 0.93 MME (0.55) MMEACEMMEL1
SCHEMBL17968666 0.92 MME (0.52) MMEACEMMEL1
SCHEMBL22331066 0.89 MME (0.79) MMEACEMMEL1
SCHEMBL19705947 0.89 MME (0.79) MMEACEMMEL1
SCHEMBL14890607 0.89 MME (0.79) MMEACEMMEL1
SCHEMBL16241271 0.89 MME (0.79) MMEACEMMEL1
SCHEMBL19665416 0.89 MME (0.47) MMEACEMMEL1
SCHEMBL19665418 0.89 MME (0.47) MMEACEMMEL1
SCHEMBL15467529 0.89 MME (0.47) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3256446-B1 (2S,4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-4-(ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID AS NEPRILYSIN INHIBITOR THERAVANCE BIOPHARMA R&D IP LLC (US) 2022-05-18 — — EP disclosed
US-9868698-B2 (2S,4R)-5-(5′-chloro-2′-fluorobiphenyl-4-yl)-4-(ethoxyoxalylamino)-2-hydroxymethyl-2-methylpentanoic acid THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-01-16 — — US disclosed
US-20170355665-A1 (2S,4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-4-(ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-12-14 — — US disclosed
US-9670143-B2 (2S,4R)-5-(5′-chloro-2′-fluorobiphenyl-4-yl)-4-(ethoxyoxalylamino)-2-hydroxmethyl-2-methylpentanoic acid THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-06-06 — — US disclosed
US-20170088508-A1 (2S,4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-4-(ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-03-30 — — US disclosed
US-9433598-B2 (2S,4R)-5-(5′-chloro-2′-fluorobiphenyl-4-yl)-4-(ethoxyoxalylamino)-2-hydroxymethyl-2-methylpentanoic acid THERAVANCE BIOPHARMA R&D IP, LLC (US) 2016-09-06 — — US disclosed
US-20160228395-A1 (2S,4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-4-(ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID THERAVANCE BIOPHARMA R&D IP, LLC (US) 2016-08-11 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170088508-A1 (2S,4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-4-(ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID MME, DNPEP, CMA1 MME 1/4885ACE 4/4885MMEL1 74/4885
US-20170355665-A1 (2S,4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-4-(ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID MME, DNPEP, CMA1 MME 1/4885ACE 4/4885MMEL1 74/4885
US-20160228395-A1 (2S,4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-4-(ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID MME, DNPEP, CMA1 MME 1/4885ACE 4/4885MMEL1 74/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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