SCHEMBL30695569

SCHEMBL30695569

N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CS)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 6/20 0.56
▸ OPRD1 P41143 5/20 0.56
▸ SLC6A2 P23975 1/20 0.54
▸ EPHA2 P29317 2/20 0.53
▸ NPFFR1 Q9GZQ6 2/20 0.53
▸ NPFFR2 Q9Y5X5 2/20 0.53
▸ NTSR2 O95665 3/20 0.52
▸ NTSR1 P30989 3/20 0.52
▸ SORT1 Q99523 2/20 0.52
▸ NMUR2 Q9GZQ4 1/20 0.52
▸ NMUR1 Q9HB89 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
SCHEMBL30772917 0.96 OPRM1 (0.58) OPRM1OPRD1SLC6A2EPHA2NPFFR1
SCHEMBL30695568 0.95 OPRM1 (0.56) OPRM1OPRD1SLC6A2EPHA2NPFFR1
SCHEMBL31473044 0.92 NMUR2 (0.58) OPRM1OPRD1EPHA2NMUR2NMUR1
SCHEMBL31289578 0.91 OPRM1 (0.57) OPRM1OPRD1SLC6A2EPHA2NMUR2
SCHEMBL29496918 0.90 SLC6A2 (0.57) OPRM1OPRD1SLC6A2EPHA2NTSR2
SCHEMBL29496917 0.90 SLC6A2 (0.57) OPRM1OPRD1SLC6A2EPHA2NTSR2
SCHEMBL31692757 0.90 NTSR2 (0.53) OPRM1OPRD1NTSR2NTSR1SORT1
SCHEMBL31676699 0.90 OPRM1 (0.57) OPRM1OPRD1SLC6A2NPFFR1NPFFR2
SCHEMBL29663605 0.89 NMUR2 (0.55) OPRM1OPRD1EPHA2NMUR2NMUR1
SCHEMBL32664435 0.89 NTSR2 (0.58) OPRM1OPRD1SLC6A2NPFFR1NPFFR2

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-117343138-B Flower gum oligopeptide and application thereof in treating fatty liver diseases 大连深蓝肽科技研发有限公司 2024-09-27 — — CN disclosed
CN-117343138-A Flower gum oligopeptide and application thereof in treating fatty liver diseases 大连深蓝肽科技研发有限公司 2024-01-05 — — CN disclosed
CN-117257972-A Targeted complex for treating fatty liver of cat and preparation method thereof 大连深蓝肽科技研发有限公司 2023-12-22 — — CN disclosed
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