SCHEMBL25487396

SCHEMBL25487396

CC(C)C[C@H](N)C(=O)N[C@@H](CCC(=O)C=[N+]=N)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.43
NOD1 Q9Y239 1/20 0.39
SLC7A5 Q01650 1/20 0.39
MME P08473 3/20 0.37
ERAP2 Q6P179 1/20 0.36
ERAP1 Q9NZ08 1/20 0.36
LNPEP Q9UIQ6 1/20 0.36
NAALAD2 Q9Y3Q0 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.35
LAP3 P28838 3/20 0.35
ANPEP P15144 2/20 0.35
RNPEP Q9H4A4 2/20 0.35
DNPEP Q9ULA0 1/20 0.35

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
SCHEMBL20465424 0.87 FOLH1 (0.43) FOLH1NOD1SLC7A5MMEERAP2
SCHEMBL18452391 0.87 FOLH1 (0.43) FOLH1NOD1SLC7A5MMEERAP2
SCHEMBL20468541 0.85 ANPEP (0.32) FOLH1MMEERAP2ANPEPRNPEP
SCHEMBL20468520 0.85 L3MBTL1 (0.39) NOD1MMEERAP2ANPEPRNPEP
SCHEMBL20468544 0.85 FOLH1 (0.46) FOLH1NOD1SLC7A5MMEERAP2
SCHEMBL25760735 0.83 FOLH1 (0.46) FOLH1NOD1SLC7A5MMEERAP2
SCHEMBL25488443 0.83 NPY4R (0.35) MMEERAP2ANPEPRNPEPDNPEP
SCHEMBL25760775 0.83 L3MBTL1 (0.37) NOD1
SCHEMBL18452768 0.81 FOLH1 (0.38) FOLH1NOD1SLC7A5MMEERAP2
SCHEMBL14941316 0.81 FOLH1 (0.64) FOLH1NOD1SLC7A5MMENAALAD2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3328827-B1 PRODRUGS OF GLUTAMINE ANALOGS UNIV JOHNS HOPKINS (US) 2023-07-05 EP disclosed
WO-2023081832-A1 METHODS FOR PREVENTING AND TREATING ACUTE KIDNEY INJURY THE JOHNS HOPKINS UNIVERSITY (US) 2023-05-11 WO disclosed