SCHEMBL16939705

SCHEMBL16939705

CB(O)N1C(=O)[C@](C)(C(N)=O)C[C@H]1Cc1ccc(-c2cc(Cl)ccc2F)cc1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FASN P49327 1/20 0.35
▸ MME P08473 13/20 0.34
▸ FFAR4 Q5NUL3 4/20 0.34
▸ CTSD P07339 1/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ ACE P12821 1/20 0.32

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
SCHEMBL16939708 0.81 MME (0.36) FASNMMEFFAR4CTSDBACE1
SCHEMBL20363548 0.81 MME (0.36) FASNMMEFFAR4CTSDBACE1
SCHEMBL16942396 0.80 PAK1 (0.34) FASNMMEFFAR4CTSDBACE1
SCHEMBL16939238 0.78 MME (0.36) FASNMMEFFAR4ACE
SCHEMBL16939700 0.77 MME (0.37) MMEACE
SCHEMBL16939704 0.76 FFAR4 (0.36) FASNMMEFFAR4ACE
SCHEMBL19376934 0.73 FFAR4 (0.38) FASNMMEFFAR4CTSDBACE1
SCHEMBL19331563 0.71 FASN (0.35) FASNMMEFFAR4CTSDBACE1
SCHEMBL19086062 0.71 MME (0.33) FASNMMEFFAR4ACE
SCHEMBL19355013 0.71 FFAR4 (0.35) FASNMMEFFAR4ACE

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180193338-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-07-12 — — US disclosed
US-9839639-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-12-12 — — US disclosed
US-20170189399-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-07-06 — — US disclosed
US-9585882-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-03-07 — — US disclosed
US-20150209352-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-07-30 — — 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-20180193338-A1 NEPRILYSIN INHIBITORS MME, REN, ACE FASN 3583/4885MME 1/4885FFAR4 3166/4885
US-20150209352-A1 NEPRILYSIN INHIBITORS MME, REN, ACE FASN 3583/4885MME 1/4885FFAR4 3166/4885
US-20170189399-A1 NEPRILYSIN INHIBITORS MME, REN, ACE FASN 3583/4885MME 1/4885FFAR4 3166/4885

“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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