SCHEMBL9301709

SCHEMBL9301709

NC(CCC(=O)O)C(=O)N(C(=O)OCc1ccccc1)C(Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.42
CPA3 P15088 1/20 0.40
LTA4H P09960 4/20 0.40
FOLH1 Q04609 3/20 0.40
SLC15A1 P46059 2/20 0.40
NAALAD2 Q9Y3Q0 1/20 0.40
SLC1A3 P43003 1/20 0.39
SLC1A1 P43005 1/20 0.39
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
ALPI P09923 1/20 0.38
PKM P14618 1/20 0.38
PTGS1 P23219 1/20 0.38
XIAP P98170 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
LAP3 P28838 2/20 0.38
LMNA P02545 1/20 0.38
ANPEP P15144 2/20 0.38

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
SCHEMBL31482431 0.90 SLC7A5 (0.50) SLC7A5LTA4HSLC15A1SLC1A3SLC1A1
SCHEMBL28790921 0.85 SLC15A1 (0.50) SLC7A5LTA4HSLC15A1SLC1A3SLC1A1
SCHEMBL5178748 0.82 SLC1A3 (0.39) SLC7A5LTA4HSLC15A1SLC1A3SLC1A1
SCHEMBL8821943 0.81 SLC15A1 (0.52) SLC7A5CPA3LTA4HSLC15A1NAALAD2
SCHEMBL22804098 0.81 ALDH1A1 (0.46) SLC7A5SLC15A1CTSLCTSBCTSS
SCHEMBL22804079 0.81 ALDH1A1 (0.46) SLC7A5SLC15A1CTSLCTSBCTSS
SCHEMBL27809385 0.80 ANPEP (0.48) SLC7A5LTA4HSLC15A1SLC1A3SLC1A1
SCHEMBL10901317 0.79 SLC15A1 (0.43) SLC7A5LTA4HSLC15A1SLC1A3SLC1A1
SCHEMBL11280290 0.79 SLC15A1 (0.43) SLC7A5LTA4HSLC15A1SLC1A3SLC1A1
SCHEMBL2478309 0.79 ANPEP (0.40) SLC7A5LTA4HSLC15A1CTSLCTSB

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
JP-6062854-A None JP disclosed
CN-110582562-B Aspergillus fermentation product, food composition, cosmetic composition, raw material for Aspergillus fermentation product, process for producing Aspergillus fermentation product, and enzyme production promoter 悠绿那股份有限公司 2021-06-08 CN disclosed
CN-110582562-A Aspergillus fermentation product, food composition, cosmetic composition, raw material for Aspergillus fermentation product, process for producing Aspergillus fermentation product, and enzyme production promoter 悠绿那股份有限公司 2019-12-17 CN disclosed
JP-H0662854-A NEW ACIDIC CARBOCYPEPTIDASE AND ITS PRODUCTION T HASEGAWA CO LTD 1994-03-08 JP disclosed