SCHEMBL31362658

SCHEMBL31362658

CSCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 1/20 0.55
▸ AGTR2 P50052 1/20 0.55
▸ REN P00797 2/20 0.54
▸ NTSR1 P30989 4/20 0.54
▸ NTSR2 O95665 3/20 0.54
▸ SORT1 Q99523 3/20 0.54
▸ SLC6A2 P23975 1/20 0.54
▸ F2 P00734 1/20 0.53
▸ OPRM1 P35372 1/20 0.52
▸ OPRD1 P41143 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
SCHEMBL31362624 0.94 SLC6A2 (0.59) AGTR1AGTR2RENNTSR1NTSR2
SCHEMBL31362693 0.93 OPRM1 (0.55) NTSR1NTSR2SORT1SLC6A2F2
SCHEMBL31362628 0.92 OPRD1 (0.53) AGTR1AGTR2NTSR1NTSR2SORT1
SCHEMBL31362720 0.91 SLC6A2 (0.59) AGTR1AGTR2RENNTSR1NTSR2
SCHEMBL31362619 0.88 ACE (0.59) F2OPRM1OPRD1
SCHEMBL31362671 0.88 OPRM1 (0.54) SLC6A2F2OPRM1OPRD1
SCHEMBL29416554 0.87 SLC6A2 (0.64) RENSLC6A2OPRM1
SCHEMBL31362717 0.87 OPRM1 (0.55) SLC6A2F2OPRM1OPRD1
SCHEMBL30486007 0.86 NTSR1 (0.59) AGTR1AGTR2NTSR1NTSR2SORT1
SCHEMBL30973991 0.86 CALCRL (0.57) RENNTSR1NTSR2SORT1SLC6A2

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-119390815-A Whey protein peptide, whey protein fermentation concentrate, and preparation method and application thereof 张少辉 2025-02-07 — — CN claimed
CN-119390815-A Whey protein peptide, whey protein fermentation concentrate, and preparation method and application thereof 张少辉 2025-02-07 — — CN disclosed
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