SCHEMBL7399838

SCHEMBL7399838

C[C@H](CS)C(=O)O[C@@H](CCl)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 2/20 0.36
CYP1A2 P05177 1/20 0.32
ACE P12821 1/20 0.31
FOLH1 Q04609 3/20 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
SCHEMBL7399836 1.00 ENPEP (0.36) ENPEPCYP1A2ACEFOLH1
Amantadine SCHEMBL9298960 0.82 THRB (0.38)
Amantadine SCHEMBL7435558 0.82 THRB (0.38)
SCHEMBL3218131 0.80 ENPEP (0.35) ENPEPCYP1A2ACE
SCHEMBL3218126 0.80 ENPEP (0.35) ENPEPCYP1A2ACE
SCHEMBL6472491 0.80 ENPEP (0.35) ENPEPCYP1A2ACE
SCHEMBL7397291 0.79 ENPEP (0.34) ENPEPCYP1A2ACE
SCHEMBL7397575 0.79 ENPEP (0.34) ENPEPCYP1A2ACE
SCHEMBL7398558 0.79 ENPEP (0.34) ENPEPCYP1A2
SCHEMBL7397297 0.79 ENPEP (0.34) ENPEPCYP1A2ACE

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 6 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 claimed
EP-0535042-A1 ANGIOTENSIS CONVERTING ENZYME INHIBITORS. FISONS PLC (GB) 1993-04-07 EP claimed
WO-1992000276-A2 ANGIOTENSIS CONVERTING ENZYME INHIBITORS FISONS PLC (GB) 1992-01-09 WO claimed
EP-0535042-B1 ANGIOTENSIS CONVERTING ENZYME INHIBITORS FISONS PLC (GB) 1995-03-29 EP 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