SCHEMBL29630655

SCHEMBL29630655

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

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.61
OPRM1 P35372 3/20 0.57
OPRD1 P41143 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
SCHEMBL30310098 0.93 OPRM1 (0.62) SLC6A2OPRM1OPRD1
SCHEMBL31676579 0.92 OPRM1 (0.63) SLC6A2OPRM1OPRD1
SCHEMBL30310086 0.91 OPRM1 (0.64) SLC6A2OPRM1OPRD1
SCHEMBL29630330 0.91 SLC6A2 (0.63) SLC6A2OPRM1OPRD1
SCHEMBL29630671 0.91 SLC6A2 (0.67) SLC6A2OPRM1OPRD1
SCHEMBL29590990 0.89 OPRM1 (0.67) SLC6A2OPRM1OPRD1
SCHEMBL29630405 0.88 SLC6A2 (0.59) SLC6A2OPRM1OPRD1
SCHEMBL31506595 0.87 SLC6A2 (0.63) SLC6A2OPRM1OPRD1
SCHEMBL29630474 0.86 SLC6A2 (0.66) SLC6A2OPRM1OPRD1
SCHEMBL31675110 0.86 OPRM1 (0.60) SLC6A2OPRM1OPRD1

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-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 US disclosed