SCHEMBL29488141

SCHEMBL29488141

C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.73
OPRM1 P35372 5/20 0.60
OPRD1 P41143 4/20 0.60
CALCRL Q16602 1/20 0.55
REN P00797 1/20 0.54

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
SCHEMBL29855844 0.96 SLC6A2 (0.69) SLC6A2OPRM1OPRD1CALCRL
SCHEMBL31207218 0.96 SLC6A2 (0.69) SLC6A2OPRM1OPRD1CALCRL
SCHEMBL29591704 0.93 SLC6A2 (0.67) SLC6A2OPRM1OPRD1CALCRLREN
SCHEMBL29590309 0.92 SLC6A2 (0.63) SLC6A2OPRM1OPRD1CALCRL
SCHEMBL29630748 0.92 SLC6A2 (0.67) SLC6A2OPRM1OPRD1
SCHEMBL29630770 0.91 SLC6A2 (0.67) SLC6A2OPRM1OPRD1
SCHEMBL29591075 0.91 SLC6A2 (0.64) SLC6A2OPRM1OPRD1
SCHEMBL29630671 0.90 SLC6A2 (0.67) SLC6A2OPRM1OPRD1REN
SCHEMBL29592716 0.90 SLC6A2 (0.64) SLC6A2OPRM1OPRD1CALCRLREN
SCHEMBL29590275 0.90 SLC6A2 (0.64) SLC6A2OPRM1OPRD1CALCRL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114527054-B Method for researching stability and intracellular localization of phosphorylated p53 based on phase separation 华南理工大学 2024-03-08 CN disclosed
CN-117396230-A Targeted conjugates with therapeutic agents and oligonucleotides and uses thereof 上海联进生物科技有限公司 2024-01-12 CN disclosed
CN-114945682-A Biochemical reaction method and reagent containing inherent disorder region 生物坩埚有限公司 2022-08-26 CN disclosed
CN-114527054-A Method for researching stability and intracellular localization of phosphorylated p53 based on phase separation 华南理工大学 2022-05-24 CN disclosed
CN-114249712-A Pyrimidinyl derivatives, method for the production thereof and use thereof 广州费米子科技有限责任公司 2022-03-29 CN disclosed
CN-112795542-B Hybridoma cell capable of secreting porcine RNAPII monoclonal antibody and application 华中农业大学 2022-03-25 CN disclosed