SCHEMBL2543449

SCHEMBL2543449

C[C@@H]([C@H](C)O)[C@H](N)C(=O)NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MME P08473 7/20 0.57
ACE P12821 4/20 0.56
CPA1 P15085 4/20 0.56
ACE2 Q9BYF1 4/20 0.56

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
SCHEMBL2543451 1.00 MME (0.57) MMEACECPA1ACE2
SCHEMBL233445 0.92 MME (0.60) MMEACECPA1ACE2
SCHEMBL31174325 0.92 MME (0.60) MMEACECPA1ACE2
SCHEMBL1864186 0.92 MME (0.60) MMEACECPA1ACE2
SCHEMBL233444 0.92 MME (0.60) MMEACECPA1ACE2
SCHEMBL30735528 0.89 MME (0.57) MMEACECPA1ACE2
Mdl-28170 SCHEMBL7335375 0.87 MME (0.61) MMEACECPA1ACE2
Mdl-28170 SCHEMBL30873029 0.87 MME (0.61) MMEACECPA1ACE2
Mdl-28170 SCHEMBL11370994 0.87 MME (0.61) MMEACECPA1ACE2
SCHEMBL29877007 0.86 MME (0.55) MMEACECPA1ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110262962-A1 METHOD FOR PRODUCING PEPTIDES AJINOMOTO CO., INC. (JP) 2011-10-27 US disclosed
US-20070292916-A1 MUTANT PROTEIN HAVING THE PEPTIDE-SYNTHESIZING ACTIVITY AJINOMOTO CO., INC. (JP) 2007-12-20 US disclosed
EP-1829968-A1 MUTANT PROTEIN HAVING PEPTIDE-PRODUCTION ACTIVITY Ajinomoto Co., Inc. (JP) 2007-09-05 EP disclosed
US-20070190602-A1 Mutant protein having the peptide-synthesizing activity AJINOMOTO CO., INC (JP) 2007-08-16 US disclosed