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Sugi Predict / Compounds / SCHEMBL31362697

SCHEMBL31362697

SCHEMBL31362697

CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 2/20 0.56
▸ LNPEP Q9UIQ6 3/20 0.55
▸ SLC6A2 P23975 1/20 0.55
▸ OPRD1 P41143 1/20 0.53
▸ ACE P12821 1/20 0.52
▸ ANPEP P15144 1/20 0.52
▸ XIAP P98170 1/20 0.51

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
SCHEMBL31362648 0.94 LNPEP (0.59) OPRM1LNPEPSLC6A2OPRD1ANPEP
SCHEMBL30634741 0.90 OPRM1 (0.66) OPRM1OPRD1ACE
SCHEMBL31362645 0.86 LNPEP (0.59) OPRM1LNPEPSLC6A2ANPEP
SCHEMBL30051261 0.86 ACE (0.62) ACE
SCHEMBL29589786 0.85 ACE (0.56) ACE
SCHEMBL31005047 0.84 LNPEP (0.54) OPRM1LNPEPSLC6A2ACEANPEP
SCHEMBL31039489 0.83 SLC6A2 (0.70) OPRM1SLC6A2OPRD1
SCHEMBL29666817 0.83 ACE (0.58) ACEXIAP
SCHEMBL29368129 0.83 OPRM1 (0.74) OPRM1OPRD1
SCHEMBL22413056 0.82 OPRM1 (0.61) OPRM1SLC6A2OPRD1

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