SCHEMBL31547374

SCHEMBL31547374

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CN)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 15/20 0.70
▸ C5AR1 P21730 2/20 0.70
▸ NPY1R P25929 1/20 0.69
▸ NPY2R P49146 1/20 0.69
▸ NPY4R P50391 1/20 0.69
▸ NPY5R Q15761 1/20 0.69
▸ CCKBR P32239 2/20 0.64
▸ KEAP1 Q14145 1/20 0.64
▸ GCGR P47871 3/20 0.63

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
SCHEMBL31402803 0.99 GLP1R (0.69) GLP1RC5AR1NPY1RNPY2RNPY4R
SCHEMBL31402801 0.94 C5AR1 (0.71) GLP1RC5AR1NPY1RNPY2RNPY4R
SCHEMBL31547375 0.93 NPY2R (0.71) GLP1RC5AR1NPY1RNPY2RNPY4R
SCHEMBL30598171 0.93 GLP1R (0.71) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL31547378 0.93 NPY2R (0.72) GLP1RC5AR1NPY1RNPY2RNPY4R
SCHEMBL31182592 0.93 C5AR1 (0.68) GLP1RC5AR1NPY1RNPY2RNPY4R
SCHEMBL30495753 0.92 NPY1R (0.70) GLP1RC5AR1NPY1RNPY2RNPY4R
SCHEMBL30598153 0.92 NPY1R (0.70) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL30598194 0.92 NPY1R (0.71) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL30598183 0.92 NPY1R (0.70) GLP1RNPY1RNPY2RNPY4RNPY5R

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-119735644-A Small molecular peptide composition for promoting production of natural bezoar and application thereof 北京知筹科技有限公司 2025-04-01 — — CN claimed
CN-119735644-A Small molecular peptide composition for promoting production of natural bezoar and application thereof 北京知筹科技有限公司 2025-04-01 — — CN disclosed
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