SCHEMBL29461794

SCHEMBL29461794

NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TACR1 P25103 1/20 0.56
▸ OPRM1 P35372 1/20 0.54
▸ DPP3 Q9NY33 1/20 0.53

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
SCHEMBL29547724 0.94 OPRM1 (0.55) OPRM1
SCHEMBL23381025 0.91 OPRM1 (0.56) TACR1OPRM1DPP3
SCHEMBL29630642 0.86 OPRM1 (0.49) OPRM1
SCHEMBL21954050 0.84 CCKBR (0.60) OPRM1
SCHEMBL30051198 0.82 DPP3 (0.60) TACR1DPP3
SCHEMBL1373182 0.82 OPRM1 (0.58) OPRM1
SCHEMBL1373185 0.82 OPRM1 (0.58) OPRM1
SCHEMBL31278597 0.82 CCKBR (0.58) TACR1
SCHEMBL31670608 0.81 DPP3 (0.55) TACR1OPRM1DPP3
SCHEMBL23381319 0.81 TACR1 (0.55) TACR1OPRM1DPP3

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-112094316-B High-zinc-chelating-activity zinc chelating peptide with Ser and Cys arranged at two ends and application thereof 安徽省农业科学院农产品加工研究所 2022-04-08 — — CN disclosed
CN-111925411-B Cys-Ser-containing high-zinc-chelating-activity zinc chelating peptide and application thereof 安徽省农业科学院农产品加工研究所 2022-04-08 — — CN disclosed
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