SCHEMBL11074641

SCHEMBL11074641

CC(NC(=O)[C@H](Cc1ccccc1)N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)OCOC(=O)C(C)(C)C)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MME P08473 10/20 0.48
ACE P12821 4/20 0.46
ACE2 Q9BYF1 4/20 0.46
CPA1 P15085 3/20 0.46
ANPEP P15144 1/20 0.45
MMEL1 Q495T6 1/20 0.44
LTA4H P09960 1/20 0.44

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
SCHEMBL10647590 1.00 MME (0.48) MMEACEACE2CPA1ANPEP
SCHEMBL7377272 0.88 MME (0.56) MMEACEACE2CPA1
SCHEMBL7377914 0.88 MME (0.42) MMEACEACE2CPA1MMEL1
SCHEMBL7375938 0.88 MME (0.42) MMEACEACE2CPA1MMEL1
SCHEMBL7381309 0.87 MME (0.42) MMEACEACE2CPA1MMEL1
SCHEMBL11072416 0.86 MME (0.42) MMEACEACE2CPA1MMEL1
SCHEMBL11074282 0.84 CTSS (0.42) MMEACEACE2CPA1MMEL1
SCHEMBL7380274 0.84 MME (0.46) MMEACEACE2CPA1
SCHEMBL7381805 0.83 ALDH1A1 (0.41) LTA4H
SCHEMBL10648066 0.83 ALDH1A1 (0.41) MMEACEACE2CPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0103077-A2 Substituted dipeptides, methods for their production, pharmaceutical compositions containing them, method for making such pharmaceutical compositions SCHERING CORPORATION (US) 1984-03-21 EP disclosed