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SCHEMBL31410841

SCHEMBL31410841

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

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 15/20 0.45
▸ BACE2 Q9Y5Z0 3/20 0.43
▸ GLP1R P43220 3/20 0.42
▸ SCTR P47872 1/20 0.42
▸ CTSD P07339 2/20 0.41

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
SCHEMBL31410884 0.95 BACE1 (0.48) BACE1BACE2GLP1RSCTRCTSD
SCHEMBL31410826 0.91 GLP1R (0.47) BACE1BACE2GLP1RSCTR
SCHEMBL30997475 0.89 F2 (0.41) BACE1GLP1RSCTR
SCHEMBL29492577 0.89 BACE1 (0.41) BACE1BACE2GLP1RSCTR
SCHEMBL31307258 0.88 GLP1R (0.51) BACE1BACE2GLP1R
SCHEMBL30123019 0.88 MAGI3 (0.44) BACE1GLP1RSCTRCTSD
SCHEMBL30495616 0.88 GLP1R (0.52) GLP1RSCTR
SCHEMBL29980611 0.87 OPRM1 (0.36) BACE1BACE2GLP1RSCTR
SCHEMBL30320554 0.87 BACE1 (0.51) BACE1BACE2GLP1RSCTRCTSD
SCHEMBL30640025 0.86 BACE1 (0.48) BACE1BACE2CTSD

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
WO-2025002589-A1 TISSUE EXTRACELLULAR PEPTIDE PATTERNS DEDICATED FOR GENERATION OF ANTI-CANCER VACCINES AGAINST SALIVARY GLAND TUMOR, IDENTIFICATION AND ISOLATION OF SALIVARY GLAND TUMOR SPECIFIC T CELLS IN HUMANS Uniwersytet Gdański (PL) 2025-01-02 — — WO claimed
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