SCHEMBL19687928

SCHEMBL19687928

CC(C)(C)OC(=O)N[C@H](Cc1ccc(-c2cccc(C#N)c2)cc1)C[C@@](C)(CCO)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSS P25774 10/20 0.52
CTSK P43235 9/20 0.52
MME P08473 8/20 0.49
ACE P12821 4/20 0.49
CTSB P07858 4/20 0.49
PTPN1 P18031 1/20 0.47
CTSL P07711 1/20 0.45

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
SCHEMBL15472646 0.93 MME (0.58) CTSSCTSKMMEACECTSB
SCHEMBL19788094 0.93 MME (0.58) CTSSCTSKMMEACECTSB
SCHEMBL19605688 0.86 MME (0.61) CTSSCTSKMMEACECTSB
SCHEMBL18386344 0.86 MME (0.61) CTSSCTSKMMEACECTSB
SCHEMBL26380938 0.83 MME (0.47) MMEACE
SCHEMBL19687906 0.83 MME (0.47) MMEACE
SCHEMBL22389976 0.80 MME (0.73) CTSSCTSKMMEACECTSB
SCHEMBL22389975 0.80 MME (0.73) CTSSCTSKMMEACECTSB
SCHEMBL11969530 0.80 MME (0.73) CTSSCTSKMMEACECTSB
SCHEMBL2074655 0.79 CTSC (0.57) CTSSCTSKMMECTSBPTPN1

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
US-20170349574-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-12-07 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 (1 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-20170349574-A1 NEPRILYSIN INHIBITORS MME, REN, ACE CTSS 69/4885CTSK 109/4885MME 1/4885

“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.