SCHEMBL30456567

SCHEMBL30456567

C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 4/20 0.54
▸ OPRD1 P41143 4/20 0.54
▸ SLC6A2 P23975 1/20 0.52
▸ CALCRL Q16602 3/20 0.51
▸ CMA1 P23946 2/20 0.50
▸ OPRK1 P41145 1/20 0.49

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
SCHEMBL31362684 0.85 CALCRL (0.60) OPRM1OPRD1SLC6A2CALCRLCMA1
SCHEMBL30444185 0.84 CALCRL (0.57) OPRM1OPRD1SLC6A2CALCRLCMA1
SCHEMBL29723433 0.84 F2 (0.50) OPRM1OPRD1SLC6A2
SCHEMBL30607218 0.84 OPRD1 (0.53) OPRM1OPRD1SLC6A2CALCRL
SCHEMBL30444297 0.83 CALCRL (0.61) OPRM1OPRD1CALCRLOPRK1
SCHEMBL31122219 0.83 CALCRL (0.49) OPRM1OPRD1CALCRLOPRK1
SCHEMBL30687939 0.82 OPRM1 (0.58) OPRM1OPRD1
SCHEMBL30444544 0.82 CMA1 (0.58) OPRM1SLC6A2CMA1
SCHEMBL29349609 0.81 POLB (0.68) OPRM1OPRD1CMA1OPRK1
SCHEMBL7383518 0.81 ACE (0.62) —

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-116178494-B Anti-alcohol polypeptide 郑州大学 2025-04-25 — — CN disclosed
CN-116178494-A Anti-alcohol polypeptide 郑州大学 2023-05-30 — — CN disclosed
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