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SCHEMBL31040682

SCHEMBL31040682

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

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 10/20 0.58
▸ OPRM1 P35372 4/20 0.57
▸ OPRK1 P41145 1/20 0.55

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
SCHEMBL8341612 0.89 OPRD1 (0.55) OPRD1OPRM1OPRK1
SCHEMBL8341607 0.89 OPRD1 (0.55) OPRD1OPRM1OPRK1
SCHEMBL29679540 0.87 OPRD1 (0.57) OPRD1OPRM1OPRK1
SCHEMBL30528331 0.85 OPRD1 (0.54) OPRD1OPRM1OPRK1
SCHEMBL2195454 0.84 OPRD1 (0.55) OPRD1OPRK1
SCHEMBL29358225 0.84 OPRD1 (0.68) OPRD1OPRM1OPRK1
SCHEMBL29679546 0.83 OPRD1 (0.60) OPRD1OPRM1
SCHEMBL29655865 0.83 OPRD1 (0.61) OPRD1OPRM1OPRK1
SCHEMBL29679827 0.83 OPRK1 (0.69) OPRK1
SCHEMBL34461869 0.83 OPRD1 (0.60) OPRD1OPRM1

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-118416200-A Preparation and application of nano selenium-ovalbumin peptide complex with immunoregulation function 吉林大学 2024-08-02 — — CN claimed
CN-118416200-A Preparation and application of nano selenium-ovalbumin peptide complex with immunoregulation function 吉林大学 2024-08-02 — — CN disclosed
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