SCHEMBL11760152

SCHEMBL11760152

C[C@@H](NC(=O)[C@@H](N)Cc1ccc(OCc2ccccc2)cc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 3/20 0.59
LTA4H P09960 3/20 0.57
PPARG P37231 3/20 0.57
MME P08473 1/20 0.56
ACE P12821 1/20 0.56
CPA1 P15085 1/20 0.56
ACE2 Q9BYF1 1/20 0.56
PSMB1 P20618 1/20 0.56
PSMB9 P28065 1/20 0.56
PSMB5 P28074 1/20 0.56
PSMB10 P40306 1/20 0.56
PSMB2 P49721 1/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
PPARA Q07869 1/20 0.53
LAP3 P28838 1/20 0.53
MMP9 P14780 1/20 0.53
MMP8 P22894 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
SCHEMBL1711543 0.87 LTA4H (0.64) LTA4HMMEACE
SCHEMBL11113147 0.87 LTA4H (0.64) LTA4HMMEACE
SCHEMBL8787479 0.87 LTA4H (0.64) LTA4HMMEACE
SCHEMBL30025974 0.87 LTA4H (0.64) LTA4HMMEACE
SCHEMBL1711542 0.87 LTA4H (0.64) LTA4HMMEACE
SCHEMBL11759037 0.86 MME (0.56) LTA4HPPARGMMEACECPA1
SCHEMBL11762373 0.85 LNPEP (0.54) LNPEPLTA4HPPARGMMEACE
SCHEMBL11762365 0.85 LNPEP (0.54) LNPEPLTA4HPPARGMMEACE
SCHEMBL7281929 0.85 MMP9 (0.63) LNPEPLTA4HPPARGLAP3MMP9
SCHEMBL30051597 0.84 LTA4H (0.61) LTA4HMMEACE

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
US-4031069-A Tetrapeptides PARKE, DAVIS & COMPANY (US) 1977-06-21 US disclosed