SCHEMBL30301165

SCHEMBL30301165

C[C@@H](O)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.67
▸ KISS1R Q969F8 5/20 0.59
▸ CTSL P07711 3/20 0.58
▸ CTSS P25774 3/20 0.58
▸ CTSK P43235 3/20 0.58
▸ CTSH P09668 1/20 0.58
▸ IL23R Q5VWK5 1/20 0.56
▸ SLC6A2 P23975 1/20 0.54
▸ NPY1R P25929 1/20 0.52
▸ NPY2R P49146 1/20 0.52
▸ NPY4R P50391 1/20 0.52
▸ NPY5R Q15761 1/20 0.52
▸ GLP1R P43220 4/20 0.52
▸ GCGR P47871 3/20 0.52
▸ MC4R P32245 1/20 0.52
▸ MC5R P33032 1/20 0.52
▸ MC3R P41968 1/20 0.52
▸ MC1R Q01726 1/20 0.52
▸ CXCR4 P61073 1/20 0.52

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
SCHEMBL30609010 0.91 CTSL (0.60) C5AR1KISS1RCTSLCTSSCTSK
SCHEMBL30609016 0.91 CTSL (0.60) C5AR1KISS1RCTSLCTSSCTSK
SCHEMBL29649771 0.90 C5AR1 (0.70) C5AR1KISS1RCTSLCTSSCTSK
SCHEMBL29913348 0.89 C5AR1 (0.58) C5AR1KISS1RCTSLCTSSCTSK
SCHEMBL30609011 0.89 CTSL (0.62) C5AR1KISS1RCTSLCTSSCTSK
SCHEMBL9822027 0.89 C5AR1 (0.76) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL9821938 0.89 C5AR1 (0.76) C5AR1CTSLCTSSCTSKCTSH
SCHEMBL31729497 0.89 SLC6A2 (0.62) C5AR1KISS1RIL23RSLC6A2
SCHEMBL30577311 0.88 CTSL (0.61) C5AR1KISS1RCTSLCTSSCTSK
SCHEMBL30609005 0.88 CTSL (0.61) C5AR1KISS1RCTSLCTSSCTSK

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-115806589-B Two millet-derived oligopeptides and application thereof in treatment of metabolic syndrome 中国农业大学 2023-05-23 — — CN disclosed
CN-115806589-A Two millet-derived oligopeptides and application thereof in treatment of metabolic syndrome 中国农业大学 2023-03-17 — — CN disclosed
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