SCHEMBL31458780

SCHEMBL31458780

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

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 4/20 0.46
▸ OPRD1 P41143 4/20 0.46
▸ NAA50 Q9GZZ1 1/20 0.40
▸ BACE1 P56817 6/20 0.40
▸ BACE2 Q9Y5Z0 1/20 0.40
▸ OPRK1 P41145 1/20 0.40
▸ SYK P43405 4/20 0.40
▸ CTSD P07339 1/20 0.40
▸ EGFR P00533 1/20 0.39
▸ IL23R Q5VWK5 1/20 0.39
▸ KEAP1 Q14145 1/20 0.39

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
SCHEMBL30681783 0.90 BACE1 (0.46) BACE1BACE2CTSD
SCHEMBL30681789 0.90 BACE1 (0.46) BACE1BACE2CTSD
SCHEMBL10873455 0.87 OPRM1 (0.48) OPRM1OPRD1BACE1OPRK1CTSD
SCHEMBL10873463 0.87 OPRM1 (0.48) OPRM1OPRD1BACE1OPRK1CTSD
SCHEMBL29538092 0.85 DPP4 (0.43) BACE1BACE2CTSD
SCHEMBL31195722 0.84 OPRM1 (0.50) OPRM1OPRD1BACE1OPRK1CTSD
SCHEMBL29645141 0.84 FNTA (0.49) OPRM1OPRD1BACE1OPRK1CTSD
SCHEMBL30880875 0.83 BACE1 (0.45) BACE1BACE2CTSD
SCHEMBL30880881 0.83 BACE1 (0.45) BACE1BACE2CTSD
SCHEMBL30596284 0.83 OPRM1 (0.50) OPRM1OPRD1BACE1BACE2OPRK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119661644-A Tuna arteria rugosa enzymolysis polypeptide and preparation method and application thereof 江苏食品药品职业技术学院 2025-03-21 — — CN disclosed
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