SCHEMBL31420016

SCHEMBL31420016

CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ENPEP Q07075 9/20 0.47
▸ BACE1 P56817 6/20 0.45
▸ MDM4 O15151 1/20 0.41
▸ MDM2 Q00987 1/20 0.41
▸ BACE2 Q9Y5Z0 1/20 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
SCHEMBL31303182 0.91 BACE1 (0.48) ENPEPBACE1MDM4MDM2BACE2
SCHEMBL30274692 0.89 NAALAD2 (0.39) BACE1
SCHEMBL30974452 0.89 BACE1 (0.39) ENPEPBACE1BACE2
SCHEMBL30831910 0.88 BACE1 (0.45) ENPEPBACE1
SCHEMBL29531539 0.88 BACE1 (0.41) BACE1BACE2
SCHEMBL30719918 0.88 BACE1 (0.44) BACE1BACE2
SCHEMBL38651064 0.87 NAALAD2 (0.38) BACE1
SCHEMBL31757519 0.87 NAALAD2 (0.38) BACE1
SCHEMBL31757521 0.87 NAALAD2 (0.38) BACE1
SCHEMBL2780082 0.87 NAALAD2 (0.41) —

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-119619358-A Metabolic marker for detecting novel coronavirus combined with Epstein-Barr virus infection and application thereof 湖北医药学院附属襄阳市第一人民医院 2025-03-14 — — CN disclosed
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