SCHEMBL31239692

SCHEMBL31239692

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

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 19/20 0.39
▸ BACE2 Q9Y5Z0 5/20 0.39
▸ CTSD P07339 3/20 0.38
▸ OPRD1 P41143 1/20 0.37

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
SCHEMBL29531539 0.89 BACE1 (0.41) BACE1BACE2CTSD
SCHEMBL29790226 0.87 ERAP2 (0.39) BACE1BACE2CTSD
SCHEMBL29683498 0.86 BACE1 (0.40) BACE1BACE2CTSD
SCHEMBL30974452 0.86 BACE1 (0.39) BACE1BACE2CTSD
SCHEMBL30476106 0.85 BACE1 (0.49) BACE1BACE2CTSD
SCHEMBL30312061 0.85 BACE1 (0.46) BACE1BACE2CTSD
SCHEMBL31239703 0.85 FNTA (0.49) BACE1BACE2
SCHEMBL31302648 0.85 BACE1 (0.47) BACE1BACE2CTSD
SCHEMBL2780082 0.84 NAALAD2 (0.41) —
SCHEMBL27806354 0.84 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118662378-A Active peptide composition with skin photoaging resisting function and preparation method and application thereof 深圳市罗湖区人民医院 2024-09-20 — — CN claimed
CN-118662378-A Active peptide composition with skin photoaging resisting function and preparation method and application thereof 深圳市罗湖区人民医院 2024-09-20 — — CN disclosed
CN-118662378-A Active peptide composition with skin photoaging resisting function and preparation method and application thereof 深圳市罗湖区人民医院 2024-09-20 — — CN disclosed
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