SCHEMBL29823571

SCHEMBL29823571

CC[C@H](C)[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.47
▸ ACE P12821 3/20 0.44
▸ REN P00797 3/20 0.44
▸ NPY1R P25929 3/20 0.43
▸ NPY2R P49146 1/20 0.43
▸ NPY4R P50391 1/20 0.43
▸ NPY5R Q15761 1/20 0.43
▸ TGM2 P21980 1/20 0.42
▸ ANPEP P15144 2/20 0.41
▸ LNPEP Q9UIQ6 2/20 0.41
▸ NTSR2 O95665 1/20 0.41
▸ NTSR1 P30989 1/20 0.41
▸ ENPEP Q07075 5/20 0.41
▸ CALCRL Q16602 1/20 0.39
▸ AGTR1 P30556 1/20 0.39
▸ AGTR2 P50052 1/20 0.39

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
SCHEMBL32672659 0.88 XIAP (0.50) XIAPACERENNPY1RNPY2R
SCHEMBL30692365 0.87 ACE (0.51) XIAPACEREN
SCHEMBL29630627 0.87 ACE (0.49) XIAPACERENNPY1RNPY2R
SCHEMBL31412187 0.86 ACE (0.59) XIAPACEREN
SCHEMBL31171909 0.85 XIAP (0.46) XIAPACERENNPY1RNPY2R
SCHEMBL31316151 0.84 F2R (0.43) XIAPACERENNPY1RNPY2R
SCHEMBL29349605 0.84 ACE (0.54) ACEREN
SCHEMBL29590352 0.83 BACE1 (0.46) ACERENNPY1RNPY2RNPY4R
SCHEMBL30052312 0.83 XIAP (0.56) XIAPACERENENPEP
SCHEMBL29477125 0.82 ACE (0.50) XIAPACERENCALCRL

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
CN-114957392-B Development and preparation method and application of Morchella esculenta flavor peptide base material 云南农业大学 2024-07-19 — — CN disclosed
CN-114957392-A Development and preparation method and application of morchella flavor-developing peptide flavor base material 云南农业大学 2022-08-30 — — CN disclosed
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