SCHEMBL30724176

SCHEMBL30724176

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

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.53
▸ CALCR P30988 4/20 0.49
▸ C5AR1 P21730 1/20 0.49
▸ F2 P00734 4/20 0.48
▸ MC4R P32245 1/20 0.47
▸ OPRM1 P35372 1/20 0.47
▸ OPRD1 P41143 1/20 0.47
▸ NPY2R P49146 4/20 0.47
▸ NPY4R P50391 4/20 0.47
▸ NPY5R Q15761 4/20 0.47
▸ NPY1R P25929 3/20 0.47

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
SCHEMBL30382780 0.87 F2 (0.57) SLC6A2CALCRC5AR1F2MC4R
SCHEMBL30383056 0.86 F2 (0.53) SLC6A2C5AR1F2MC4ROPRM1
SCHEMBL4333867 0.85 C5AR1 (0.53) SLC6A2CALCRC5AR1F2OPRM1
SCHEMBL4333862 0.85 C5AR1 (0.53) SLC6A2CALCRC5AR1F2OPRM1
SCHEMBL31518658 0.85 CALCR (0.54) CALCRF2MC4RNPY2RNPY4R
SCHEMBL9407096 0.85 SLC6A2 (0.52) SLC6A2C5AR1F2OPRM1OPRD1
SCHEMBL9407098 0.85 SLC6A2 (0.52) SLC6A2C5AR1F2OPRM1OPRD1
SCHEMBL30383131 0.84 F2 (0.53) CALCRC5AR1F2MC4ROPRM1
SCHEMBL29960236 0.83 SLC6A2 (0.60) SLC6A2CALCRC5AR1F2MC4R
SCHEMBL31474361 0.83 MC4R (0.62) CALCRC5AR1F2MC4ROPRM1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117384251-A Microorganism source umami peptide, preparation method and application 沈阳农业大学 2024-01-12 — — CN claimed
CN-117384251-A Microorganism source umami peptide, preparation method and application 沈阳农业大学 2024-01-12 — — CN disclosed
CN-117384251-A Microorganism source umami peptide, preparation method and application 沈阳农业大学 2024-01-12 — — CN disclosed
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