SCHEMBL6574326

SCHEMBL6574326

CCN(C)c1ccc(COCC(NC(=O)[C@H](C)CS)C(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACE P12821 16/20 0.54
MME P08473 1/20 0.53

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
SCHEMBL6574332 1.00 ACE (0.54) ACEMME
SCHEMBL6576249 0.82 MME (0.45) ACEMME
SCHEMBL6576254 0.82 MME (0.45) ACEMME
SCHEMBL6577870 0.82 PPARA (0.47) ACEMME
SCHEMBL6577875 0.82 PPARA (0.47) ACEMME
SCHEMBL6576213 0.80 ACE (0.82) ACE
SCHEMBL6576269 0.79 PPARA (0.69) ACE
SCHEMBL8446679 0.75 ACE (0.43) ACE
SCHEMBL8451271 0.73 ACE (0.51) ACEMME
SCHEMBL8453996 0.73 MME (0.47) ACEMME

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-0870762-B1 NOVEL AMINO ACID DERIVATIVES HAVING N,N-DIALKYLAMINOPHENYL GROUP SANTEN PHARMACEUTICAL CO LTD (JP) 2004-04-28 EP disclosed
EP-0870762-A1 NOVEL AMINO ACID DERIVATIVES HAVING N,N-DIALKYLAMINOPHENYL GROUP SANTEN PHARMACEUTICAL CO., LTD. (JP) 1998-10-14 EP disclosed