SCHEMBL18922306

SCHEMBL18922306

CCOC(=O)[C@](C)(CCOC)C[C@@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 3/20 0.48
▸ CTSK P43235 2/20 0.48
▸ MME P08473 9/20 0.47
▸ ACE P12821 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ APP P05067 1/20 0.42
▸ KLK5 Q9Y337 1/20 0.41
▸ BCL2 P10415 1/20 0.41
▸ CTSL P07711 1/20 0.41
▸ CTSB P07858 1/20 0.41
▸ SCN9A Q15858 1/20 0.41
▸ PPARG P37231 1/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ SYK P43405 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
SCHEMBL21350792 0.90 MME (0.50) MMEACECTSL
SCHEMBL19687827 0.90 MME (0.51) CTSSCTSKMMEACEATM
SCHEMBL18922305 0.90 MME (0.51) CTSSCTSKMMEACEATM
SCHEMBL19687828 0.90 CTSS (0.49) CTSSCTSKMMEACEATM
SCHEMBL15474327 0.90 CTSS (0.49) CTSSCTSKMMEACEATM
SCHEMBL15468114 0.88 MME (0.58) CTSSCTSKMMEACEATM
SCHEMBL20681853 0.88 MME (0.58) CTSSCTSKMMEACEATM
SCHEMBL11995841 0.84 CTSS (0.53) CTSSCTSKMMEACEATM
SCHEMBL20681845 0.84 MME (0.46) MME
SCHEMBL26380409 0.84 MME (0.46) 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-9670186-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-06-06 — — US disclosed
Send feedback