SCHEMBL30596284

SCHEMBL30596284

CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 3/20 0.50
▸ OPRD1 P41143 3/20 0.50
▸ BACE1 P56817 13/20 0.45
▸ CTSD P07339 4/20 0.45
▸ BACE2 Q9Y5Z0 1/20 0.43
▸ KEAP1 Q14145 2/20 0.43
▸ SYK P43405 1/20 0.43
▸ OPRK1 P41145 1/20 0.41

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
SCHEMBL29815915 0.91 OPRM1 (0.50) OPRM1OPRD1BACE1CTSDBACE2
SCHEMBL29733454 0.85 BACE1 (0.49) BACE1CTSDBACE2
SCHEMBL31257236 0.84 BACE1 (0.47) BACE1CTSDBACE2
SCHEMBL30997362 0.84 BACE1 (0.53) OPRM1OPRD1BACE1CTSDBACE2
SCHEMBL29816159 0.84 BACE1 (0.53) OPRM1OPRD1BACE1CTSDBACE2
SCHEMBL31458780 0.83 OPRM1 (0.46) OPRM1OPRD1BACE1CTSDBACE2
SCHEMBL29421950 0.83 EGFR (0.54) OPRM1OPRD1BACE1CTSDBACE2
SCHEMBL29375582 0.83 DPP4 (0.47) OPRM1OPRD1BACE1CTSD
SCHEMBL29405948 0.83 FNTA (0.44) OPRM1OPRD1KEAP1
SCHEMBL11832854 0.83 OPRM1 (0.46) OPRM1OPRD1BACE1CTSDBACE2

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-116836223-B Prinsepia utilis royle active peptide composition and new application thereof 昆明理工大学 2024-10-25 — — CN claimed
CN-116836223-B Prinsepia utilis royle active peptide composition and new application thereof 昆明理工大学 2024-10-25 — — CN disclosed
CN-116836223-A Prinsepia utilis royle active peptide composition and new application thereof 昆明理工大学 2023-10-03 — — CN disclosed
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