SCHEMBL8630182

SCHEMBL8630182

NC(CC(=O)O)C(=O)N(C(=O)C(N)CC(=O)O)C(Cc1ccccc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.54
PKM P14618 1/20 0.54
PTGS1 P23219 1/20 0.54
XIAP P98170 1/20 0.54
SLC7A5 Q01650 1/20 0.54
CPA1 P15085 2/20 0.51
CPA3 P15088 2/20 0.51
CPB1 P15086 1/20 0.51
CPB2 Q96IY4 1/20 0.51
SLC1A3 P43003 2/20 0.47
SLC1A2 P43004 2/20 0.47
SLC1A1 P43005 2/20 0.47
SLC15A1 P46059 1/20 0.47
LTA4H P09960 2/20 0.45
CYP1A2 P05177 1/20 0.44
ANPEP P15144 1/20 0.43
RNPEP Q9H4A4 1/20 0.43
DNPEP Q9ULA0 1/20 0.43
SRR Q9GZT4 2/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL9499407 1.00 ALPI (0.54) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL4107271 0.92 SLC7A5 (0.50) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL10584413 0.90 SLC7A5 (0.62) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL7418449 0.87 ALPI (0.50) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL8628526 0.87 ALPI (0.50) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL11569665 0.87 SLC7A5 (0.54) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL9716075 0.85 ALPI (0.49) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL8821943 0.84 SLC15A1 (0.52) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL9516223 0.84 ALPI (0.47) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL10870312 0.84 ALPI (0.47) ALPIPKMPTGS1XIAPSLC7A5

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-0297560-B1 Imides; a process for their production and a process for the production of dipeptides using them AJINOMOTO KK (JP) 1998-03-04 EP claimed