SCHEMBL11297136

SCHEMBL11297136

CC(CSC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACE P12821 8/20 0.51
ACE2 Q9BYF1 4/20 0.51
CMA1 P23946 2/20 0.49
ELANE P08246 2/20 0.48
CTSG P08311 1/20 0.48
SLC6A2 P23975 1/20 0.48
XIAP P98170 1/20 0.47
OPRM1 P35372 1/20 0.47
TACR1 P25103 1/20 0.47
DPP3 Q9NY33 1/20 0.46

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
SCHEMBL683813 0.94 ACE (0.57) ACEACE2CMA1ELANECTSG
SCHEMBL11271619 0.94 ACE (0.57) ACEACE2CMA1ELANECTSG
SCHEMBL683814 0.89 SLC6A2 (0.56) ACEACE2SLC6A2OPRM1
SCHEMBL683506 0.87 ACE (0.54) ACEACE2CMA1SLC6A2DPP3
SCHEMBL11278066 0.87 ACE (0.54) ACEACE2CMA1SLC6A2DPP3
SCHEMBL11459782 0.87 ACE (0.54) ACEACE2CMA1SLC6A2DPP3
SCHEMBL683121 0.87 ACE (0.49) ACEACE2CMA1SLC6A2OPRM1
Alacepril SCHEMBL34559 0.87 ACE (0.55) ACEACE2CMA1SLC6A2OPRM1
Alacepril SCHEMBL11460465 0.87 ACE (0.55) ACEACE2CMA1SLC6A2OPRM1
Alacepril SCHEMBL3204613 0.87 ACE (0.55) ACEACE2CMA1SLC6A2OPRM1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0007477-B1 1-(3-MERCAPTO-2-METHYLPROPANOYL)PROLYL AMINO ACID DERIVATIVES AND SALTS THEREOF, PROCESSES FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH COMPOUNDS Dainippon Pharmaceutical Co., Ltd. (JP) 1982-04-28 EP disclosed
US-4248883-A ANTIHYPERTENSION AGENTS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1981-02-03 US disclosed