SCHEMBL20376371

SCHEMBL20376371

CCOC(=O)[C@H](CO)C[C@H](CC(=O)OC(C)(C)C)Cc1ccc(-c2ccccc2F)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 12/20 0.42
▸ PPARG P37231 2/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ MMP2 P08253 1/20 0.37
▸ MMP3 P08254 1/20 0.37
▸ CA2 P00918 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ CTSS P25774 1/20 0.34
▸ CTSK P43235 1/20 0.34
▸ ALOX5AP P20292 1/20 0.34
▸ FEN1 P39748 1/20 0.34

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
SCHEMBL14902382 0.82 MME (0.50) MMECTSSCTSK
SCHEMBL20371160 0.81 MME (0.51) MMEPPARGPPARAMMP2MMP3
SCHEMBL18597892 0.79 MME (0.48) MMEPPARGPPARACA2CA9
SCHEMBL14890510 0.79 MME (0.48) MMEPPARGPPARACA2CA9
SCHEMBL19718236 0.77 MME (0.47) MMECA2CA9CTSSCTSK
SCHEMBL19718237 0.77 MME (0.47) MMECA2CA9CTSSCTSK
SCHEMBL18386377 0.75 MME (0.46) MMEMMP2MMP3CTSSCTSK
SCHEMBL12735244 0.72 PPARG (0.48) MMEPPARGPPARACTSSCTSK
SCHEMBL18386378 0.72 MME (0.43) MMEPPARGPPARAMMP2MMP3
SCHEMBL18626444 0.70 MME (0.57) MME

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-20180194718-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-07-12 — — 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-20180194718-A1 NEPRILYSIN INHIBITORS MME, REN, ACE MME 1/4885PPARG 4847/4885PPARA 4838/4885

“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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