SCHEMBL29363345

SCHEMBL29363345

N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.46
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
GRB2 P62993 1/20 0.42
SLC6A2 P23975 1/20 0.42
F2 P00734 1/20 0.42
XIAP P98170 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
SCHEMBL17352470 0.91 OPRM1 (0.46) OPRM1F2XIAP
SCHEMBL29366371 0.91 OPRM1 (0.46) OPRM1F2XIAP
SCHEMBL29374739 0.90 OPRM1 (0.45) OPRM1OPRD1OPRK1GRB2SLC6A2
SCHEMBL31065472 0.90 OPRM1 (0.45) OPRM1OPRD1OPRK1GRB2SLC6A2
SCHEMBL29377214 0.90 DPP4 (0.50) OPRM1F2XIAP
SCHEMBL30286923 0.89 OPRM1 (0.55) OPRM1GRB2F2
SCHEMBL17352458 0.88 OPRM1 (0.43) OPRM1SLC6A2F2XIAP
SCHEMBL31316132 0.87 OPRM1 (0.54) OPRM1F2XIAP
SCHEMBL31134542 0.87 CAPN1 (0.46) OPRM1OPRD1OPRK1SLC6A2XIAP
SCHEMBL29355564 0.87 GRB2 (0.47) OPRM1GRB2F2XIAP

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
US-20230304025-A1 M13 BACTERIOPHAGE WITH A HIGH CYSTEINE CONTENT AND GENETICALLY ENGINEERABLE HYDROGELS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-09-28 US disclosed
WO-2022020380-A1 M13 BACTERIOPHAGE WITH A HIGH CYSTEINE CONTENT AND GENETICALLY ENGINEERABLE HYDROGELS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2022-01-27 WO disclosed