SCHEMBL18995171

SCHEMBL18995171

CCOC(=O)C(C[C@@H](CCc1ccc(-c2ccccc2)cc1)NC(=O)OC(C)(C)C)OC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 5/20 0.47
▸ CTSS P25774 3/20 0.47
▸ MMP12 P39900 1/20 0.45
▸ SCN9A Q15858 2/20 0.43
▸ SYK P43405 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ PPARA Q07869 5/20 0.39
▸ PPARG P37231 4/20 0.39
▸ MMP2 P08253 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ BCL2 P10415 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CTSB P07858 1/20 0.38
▸ PPARD Q03181 2/20 0.38

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
SCHEMBL21650124 0.90 CTSS (0.50) CTSKCTSSSCN9ASYKATM
SCHEMBL9963895 0.90 CTSS (0.50) CTSKCTSSSCN9ASYKATM
SCHEMBL19573703 0.86 CTSK (0.50) CTSKCTSSSCN9ASYKATM
SCHEMBL18409014 0.86 CTSK (0.50) CTSKCTSSSCN9ASYKATM
SCHEMBL19222886 0.77 MME (0.60) CTSKCTSSSCN9AMMP2MMP3
SCHEMBL22651626 0.77 CTSK (0.63) CTSKCTSSPPARAPPARGBCL2
SCHEMBL344068 0.77 CTSK (0.63) CTSKCTSSPPARAPPARGBCL2
SCHEMBL19605638 0.77 CTSK (0.63) CTSKCTSSPPARAPPARGBCL2
SCHEMBL1231410 0.76 MME (0.54) CTSKCTSSSCN9AATM
SCHEMBL21572792 0.76 MME (0.54) CTSKCTSSSCN9AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10744104-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-08-18 — — US disclosed
US-20190262297-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2019-08-29 — — US disclosed
US-20170320895-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-11-09 — — US disclosed
US-9682052-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-06-20 — — 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-10744104-B2 Neprilysin inhibitors MME, REN, ACE CTSK 123/4885CTSS 86/4885MMP12 686/4885
US-20170320895-A1 NEPRILYSIN INHIBITORS MME, REN, ACE CTSK 178/4885CTSS 117/4885MMP12 1089/4885
US-20190262297-A1 NEPRILYSIN INHIBITORS MME, REN, ACE CTSK 123/4885CTSS 86/4885MMP12 686/4885

“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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