SCHEMBL7397291

SCHEMBL7397291

CSCC(OC(=O)[C@@H](C)CS)C(=O)O.[MgH2]

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 2/20 0.34
ACE P12821 5/20 0.32
RNPEP Q9H4A4 1/20 0.32
CYP1A2 P05177 1/20 0.31

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
SCHEMBL7397297 1.00 ENPEP (0.34) ENPEPACERNPEPCYP1A2
SCHEMBL6472491 0.98 ENPEP (0.35) ENPEPACERNPEPCYP1A2
SCHEMBL3218131 0.98 ENPEP (0.35) ENPEPACERNPEPCYP1A2
SCHEMBL3218126 0.98 ENPEP (0.35) ENPEPACERNPEPCYP1A2
SCHEMBL7397577 0.97 ENPEP (0.34) ENPEPACERNPEPCYP1A2
SCHEMBL9240731 0.97 ENPEP (0.34) ENPEPACERNPEP
SCHEMBL7393959 0.97 ENPEP (0.34) ENPEPACERNPEPCYP1A2
SCHEMBL7397575 0.97 ENPEP (0.34) ENPEPACERNPEPCYP1A2
SCHEMBL7393952 0.97 ENPEP (0.34) ENPEPACERNPEP
SCHEMBL7397294 0.85

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
EP-0535042-B1 ANGIOTENSIS CONVERTING ENZYME INHIBITORS FISONS PLC (GB) 1995-03-29 EP disclosed
US-5348978-A Angiotensin converting enzyme inhibitors FISONS PLC (GB) 1994-09-20 US disclosed
EP-0535042-A1 ANGIOTENSIS CONVERTING ENZYME INHIBITORS. FISONS PLC (GB) 1993-04-07 EP disclosed
WO-1992000276-A2 ANGIOTENSIS CONVERTING ENZYME INHIBITORS FISONS PLC (GB) 1992-01-09 WO disclosed