SCHEMBL19696028

SCHEMBL19696028

CC(C)(C)OC(=O)N[C@H](Cc1ccc(-c2cc(Cl)ccc2F)cc1)CC(C)(CNC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 12/20 0.48
▸ ACE P12821 4/20 0.45
▸ SYK P43405 1/20 0.44
▸ ATM Q13315 1/20 0.42
▸ PPARA Q07869 1/20 0.42
▸ CTSS P25774 1/20 0.41
▸ CTSK P43235 1/20 0.41
▸ CTSL P07711 1/20 0.41
▸ PTPN1 P18031 1/20 0.40
▸ MMEL1 Q495T6 1/20 0.40

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
SCHEMBL16942393 1.00 MME (0.48) MMEACESYKATMPPARA
SCHEMBL17968662 0.88 MME (0.50) MMEACESYKATMMMEL1
SCHEMBL19705794 0.88 MME (0.50) MMEACESYKATMMMEL1
SCHEMBL19771839 0.87 MME (0.45) MMEACESYKATMMMEL1
SCHEMBL24381023 0.86 MME (0.41) MMEACEPPARACTSK
SCHEMBL16932429 0.86 MME (0.41) MMEACEPPARACTSK
SCHEMBL26378137 0.86 MME (0.44) MMEACESYKATMMMEL1
SCHEMBL15474326 0.86 MME (0.60) MMEACEMMEL1
SCHEMBL19696010 0.86 MME (0.60) MMEACEMMEL1
SCHEMBL19086104 0.86 MME (0.60) MMEACEMMEL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3099668-B1 5-BIPHENYL-4-HETEROARYLCARBONYLAMINO-PENTANOIC ACID DERIVATIVES AS NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP LLC (US) 2022-05-04 — — EP disclosed
US-9839639-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-12-12 — — US disclosed
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