SCHEMBL30873802

SCHEMBL30873802

CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 2/20 0.53
SIRT6 Q8N6T7 1/20 0.52
SIRT1 Q96EB6 1/20 0.52
ECE1 P42892 2/20 0.47
FOLH1 Q04609 1/20 0.46
CPA1 P15085 1/20 0.45
CPA2 P48052 1/20 0.45
CPA4 Q9UI42 1/20 0.45
SIRT5 Q9NXA8 1/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
TLR2 O60603 2/20 0.43
FURIN P09958 1/20 0.42
PCSK6 P29122 1/20 0.42
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
CPB2 Q96IY4 2/20 0.40

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
SCHEMBL29396098 0.90 GNPAT (0.60) GNPATSIRT6SIRT1FOLH1CPA1
SCHEMBL29394494 0.90 GNPAT (0.60) GNPATSIRT6SIRT1FOLH1CPA1
SCHEMBL29396725 0.90 GNPAT (0.60) GNPATSIRT6SIRT1FOLH1CPA1
SCHEMBL29517462 0.87 GNPAT (0.54) GNPATSIRT6SIRT1ECE1FOLH1
SCHEMBL29510666 0.86 GNPAT (0.52) GNPATSIRT6SIRT1ECE1FOLH1
SCHEMBL11951539 0.86 FOLH1 (0.49) GNPATSIRT6SIRT1ECE1FOLH1
SCHEMBL30924954 0.86 GSR (0.49) ECE1FOLH1CPB2
SCHEMBL32679339 0.85 SIRT6 (0.55) GNPATSIRT6SIRT1FOLH1CPA1
SCHEMBL30731554 0.84 FOLH1 (0.48) GNPATECE1FOLH1CPB2
Acetic Acid SCHEMBL10767009 0.84 SIRT6 (0.53) GNPATSIRT6SIRT1FOLH1CPA1

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
CN-117925757-A Asparagine endopeptidase mediated polypeptide cyclization method and application thereof in phage display peptide library 安徽大学 2024-04-26 CN disclosed