SCHEMBL11969461

SCHEMBL11969461

Cc1ccc(Cl)cc1-c1ccc(CN(CC(C)(O)C(=O)O)NC(=O)c2nnn[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 6/20 0.44
▸ ACE P12821 3/20 0.44
▸ MAPK14 Q16539 2/20 0.36
▸ PDK1 Q15118 2/20 0.36
▸ VEGFA P15692 1/20 0.34
▸ FLT1 P17948 1/20 0.34
▸ EGLN1 Q9GZT9 1/20 0.34
▸ SHMT1 P34896 5/20 0.33
▸ SUCNR1 Q9BXA5 1/20 0.32
▸ FFAR1 O14842 1/20 0.31
▸ MMEL1 Q495T6 1/20 0.31
▸ SHMT2 P34897 1/20 0.30
▸ P2RX3 P56373 1/20 0.30

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
SCHEMBL11969432 1.00 MME (0.44) MMEACEMAPK14PDK1VEGFA
SCHEMBL11969561 0.92 MME (0.46) MMEACEMMEL1
SCHEMBL11969580 0.92 MME (0.46) MMEACEMMEL1
SCHEMBL15324951 0.84 MME (0.55) MMEACEMAPK14PDK1VEGFA
SCHEMBL15324954 0.84 MME (0.55) MMEACEMAPK14PDK1VEGFA
SCHEMBL11969221 0.80 MME (0.45) MMEACEMAPK14PDK1VEGFA
SCHEMBL11969216 0.80 MME (0.45) MMEACEMAPK14PDK1VEGFA
SCHEMBL15324838 0.76 MME (0.52) MMEACEMMEL1
SCHEMBL15324831 0.76 MME (0.52) MMEACEMMEL1
SCHEMBL9934167 0.75 MME (0.63) MMEACE

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-20180051023-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-02-22 — — US disclosed
US-9725448-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-08-08 — — US disclosed
US-20170066764-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-03-09 — — US disclosed
US-9487514-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2016-11-08 — — US disclosed
EP-2675792-B1 SUBSTITUTED AMINOBUTYRIC DERIVATIVES AS NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP LLC (US) 2016-01-06 — — EP disclosed
US-20150133658-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-05-14 — — US disclosed
US-8846913-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2014-09-30 — — US disclosed
US-20130245260-A1 NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2013-09-19 — — US disclosed
US-8449890-B2 Neprilysin inhibitors THERAVANCE, INC. (US) 2013-05-28 — — US disclosed
US-20120213807-A1 NEPRILYSIN INHIBITORS THERAVANCE, INC. (US) 2012-08-23 — — 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 (5 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-20150133658-A1 NEPRILYSIN INHIBITORS MME, REN, EDNRB MME 1/4885ACE 5/4885MAPK14 2814/4885
US-20120213807-A1 NEPRILYSIN INHIBITORS MME, REN, EDNRB MME 1/4885ACE 5/4885MAPK14 2814/4885
US-20170066764-A1 NEPRILYSIN INHIBITORS MME, REN, EDNRB MME 1/4885ACE 5/4885MAPK14 2814/4885
US-20130245260-A1 NEPRILYSIN INHIBITORS MME, REN, EDNRB MME 1/4885ACE 5/4885MAPK14 2814/4885
US-20180051023-A1 NEPRILYSIN INHIBITORS MME, REN, EDNRB MME 1/4885ACE 5/4885MAPK14 2814/4885

“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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