SCHEMBL7571502

SCHEMBL7571502

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.42
GSTK1 Q9Y2Q3 1/20 0.42
GLO1 Q04760 1/20 0.37
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
PTGS2 P35354 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ECE1 P42892 5/20 0.35
GRIA1 P42261 1/20 0.34
GRIA3 P42263 1/20 0.34
ITGB3 P05106 2/20 0.33
ITGB1 P05556 2/20 0.33
ITGAV P06756 2/20 0.33
ITGA5 P08648 2/20 0.33
MDM4 O15151 1/20 0.33
MMP8 P22894 1/20 0.33
TERT O14746 1/20 0.32

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
SCHEMBL6136563 1.00 PTGS1 (0.42) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL3493292 1.00 PTGS1 (0.42) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL1472099 1.00 PTGS1 (0.42) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL8448660 1.00 PTGS1 (0.42) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL8147780 0.98 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL8040800 0.98 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL5507559 0.97 PTGS1 (0.40) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL9180258 0.97 PTGS1 (0.40) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL9096940 0.96 PTGS1 (0.39) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL8436887 0.95 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A

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
CN-108368517-B Methods and compositions for rapid plant transformation 先锋国际良种公司 2022-08-02 CN disclosed
CN-107920488-B Reduced gluten cereal grain and compositions thereof 阿凯笛亚生物科学公司 2022-06-21 CN disclosed
EP-1237906-A2 COMPLEMENTARY PEPTIDE LIGANDS GENERATED FROM PLANT GENOMES Proteom Limited (GB) 2002-09-11 EP disclosed
WO-2001042279-A2 COMPLEMENTARY PEPTIDE LIGANDS GENERATED FROM PLANT GENOMES PROTEOM LIMITED (GB) 2001-06-14 WO disclosed