SCHEMBL7391963

SCHEMBL7391963

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

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACE P12821 7/20 0.35
ENPEP Q07075 2/20 0.30

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
SCHEMBL7391964 1.00 ACE (0.35) ACEENPEP
Amantadine SCHEMBL7395402 0.85 THRB (0.33)
Amantadine SCHEMBL7396223 0.85 THRB (0.33)
SCHEMBL7395733 0.83 ACE (0.36) ACEENPEP
SCHEMBL7394256 0.83 ACE (0.33) ACEENPEP
SCHEMBL7397890 0.83 ACE (0.36) ACEENPEP
SCHEMBL7394255 0.83 ACE (0.33) ACEENPEP
SCHEMBL7397185 0.83 MME (0.35) ACE
SCHEMBL7397187 0.83 MME (0.35) ACE
SCHEMBL3218131 0.81 ENPEP (0.35) ACEENPEP

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 3 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