SCHEMBL7398558

SCHEMBL7398558

CC(C)OC[C@H](OC(=O)[C@H](C)CS)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 2/20 0.34
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
SCHEMBL7398554 1.00 ENPEP (0.34) ENPEPCYP1A2
Amantadine SCHEMBL7398970 0.83 THRB (0.36)
Amantadine SCHEMBL7397271 0.83 THRB (0.36)
Amantadine SCHEMBL7397276 0.83 THRB (0.36)
SCHEMBL7396705 0.81 ENPEP (0.33) ENPEP
SCHEMBL7396708 0.81 ENPEP (0.33) ENPEP
SCHEMBL7395742 0.80 MAPK1 (0.37) ENPEP
SCHEMBL7395739 0.80 MAPK1 (0.37) ENPEP
SCHEMBL9240824 0.79 PRKCA (0.42) ENPEP
SCHEMBL9240818 0.79 PRKCA (0.42) ENPEP

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 5 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
US-5348978-A Angiotensin converting enzyme inhibitors FISONS PLC (GB) 1994-09-20 US 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
US-5478946-A Treating vascular system disorders or cartilage diseases ABBOTT LABORATORIES (US) 1995-12-26 US disclosed