SCHEMBL9940447

SCHEMBL9940447

Cc1ccc(Cl)cc1-c1ccc(CN(C[C@@H](O)C(=O)O)NC(=O)c2cn(O)nn2)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 11/20 0.54
▸ ACE P12821 2/20 0.54
▸ MAPK14 Q16539 2/20 0.37
▸ PDK1 Q15118 2/20 0.37
▸ KLKB1 P03952 1/20 0.35
▸ VEGFA P15692 1/20 0.35
▸ FLT1 P17948 1/20 0.35
▸ EGLN1 Q9GZT9 1/20 0.35
▸ MAPT P10636 1/20 0.33
▸ MMEL1 Q495T6 2/20 0.33

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
SCHEMBL15324208 1.00 MME (0.54) MMEACEMAPK14PDK1KLKB1
SCHEMBL9934089 0.91 MME (0.51) MMEACEMMEL1
SCHEMBL9934094 0.91 MME (0.51) MMEACEMMEL1
SCHEMBL15324610 0.90 MME (0.62) MMEACEMMEL1
SCHEMBL9940695 0.90 MME (0.62) MMEACEMMEL1
SCHEMBL15324972 0.87 MME (0.55) MMEACEMMEL1
SCHEMBL15324971 0.87 MME (0.55) MMEACEMMEL1
SCHEMBL15324877 0.86 MME (0.66) MMEACEMMEL1
SCHEMBL15324881 0.86 MME (0.66) MMEACEMMEL1
SCHEMBL9935035 0.83 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9873696-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-01-23 — — US disclosed
US-20170217959-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-08-03 — — US disclosed
US-9555041-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-01-31 — — US disclosed
US-20160184316-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2016-06-30 — — US disclosed
US-9120758-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-09-01 — — US disclosed
EP-2651900-B1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R & D IP LLC (US) 2015-08-19 — — EP disclosed
US-20140011997-A1 NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2014-01-09 — — US disclosed
EP-2651900-A1 NEPRILYSIN INHIBITORS Theravance, Inc. (US) 2013-10-23 — — EP disclosed
US-8563512-B2 Neprilysin inhibitors THERAVANCE, INC. (US) 2013-10-22 — — US disclosed
WO-2012082857-A1 NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2012-06-21 — — WO 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-20140011997-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885ACE 3/4885MAPK14 2621/4885
US-20160184316-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885ACE 3/4885MAPK14 2621/4885
US-20170217959-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885ACE 3/4885MAPK14 2621/4885

“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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