SCHEMBL31356487

SCHEMBL31356487

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 16/20 0.63
▸ NTSR2 O95665 15/20 0.63
▸ SORT1 Q99523 13/20 0.62
▸ NPY1R P25929 3/20 0.61
▸ NPY2R P49146 1/20 0.61
▸ NPY4R P50391 1/20 0.61
▸ NPY5R Q15761 1/20 0.61

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
SCHEMBL30584176 0.92 NTSR1 (0.66) NTSR1NTSR2SORT1
SCHEMBL30584171 0.90 NTSR1 (0.60) NTSR1NTSR2SORT1NPY1RNPY2R
SCHEMBL29580406 0.90 NTSR1 (0.63) NTSR1NTSR2SORT1
SCHEMBL30584174 0.89 NTSR1 (0.66) NTSR1NTSR2SORT1
SCHEMBL29496648 0.89 NTSR1 (0.69) NTSR1NTSR2SORT1NPY1RNPY2R
SCHEMBL31182446 0.88 NTSR1 (0.66) NTSR1NTSR2SORT1
SCHEMBL32677416 0.88 BACE1 (0.60) NTSR1NTSR2SORT1
SCHEMBL2039247 0.87 NTSR1 (0.69) NTSR1NTSR2SORT1
SCHEMBL30584170 0.87 NTSR1 (0.59) NTSR1NTSR2SORT1NPY1RNPY2R
SCHEMBL31256951 0.87 NTSR1 (0.57) NTSR1NTSR2SORT1

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-119241651-A DPP-IV activity inhibition peptide, and preparation method and application thereof 齐齐哈尔大学 2025-01-03 — — CN disclosed
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