SCHEMBL9852025

SCHEMBL9852025

CC(NC(=O)C(N)CC(N)=O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.44
ACE P12821 1/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
ECE1 P42892 3/20 0.42
CTSD P07339 1/20 0.42
BACE1 P56817 1/20 0.42
DPP4 P27487 1/20 0.41
DPP8 Q6V1X1 1/20 0.41
DPP9 Q86TI2 1/20 0.41
LTA4H P09960 4/20 0.41
PDCD1LG2 Q9BQ51 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
ANPEP P15144 1/20 0.38

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
SCHEMBL29517369 1.00 MME (0.44) MMEACECPA1ACE2ECE1
SCHEMBL9852027 1.00 MME (0.44) MMEACECPA1ACE2ECE1
SCHEMBL29697058 1.00 MME (0.44) MMEACECPA1ACE2ECE1
Hydrochloric Acid SCHEMBL23404070 0.98 MME (0.43) MMEACECPA1ACE2ECE1
Hydrochloric Acid SCHEMBL23404085 0.98 MME (0.43) MMEACECPA1ACE2ECE1
SCHEMBL30629769 0.96 MME (0.42) MMEACECPA1ACE2ECE1
SCHEMBL31169711 0.92 BACE1 (0.51) MMEACECPA1ACE2ECE1
SCHEMBL30068583 0.89 BACE1 (0.44) MMEACECPA1ACE2ECE1
SCHEMBL29696975 0.89 BACE1 (0.44) MMEACECPA1ACE2ECE1
SCHEMBL31447508 0.86 DPP4 (0.42) ECE1CTSDBACE1DPP4DPP8

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-0457314-A1 Nutrient compositions containing peptides CLINTEC NUTRITION COMPANY (US) 1991-11-21 EP claimed
CN-102134315-A Polyasparaginyl-L-alanine, preparation method and medical use thereof UNIV CAPITAL MEDICAL 2011-07-27 CN disclosed