SCHEMBL29630671

SCHEMBL29630671

C[C@@H](O)[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 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.67
OPRM1 P35372 3/20 0.54
REN P00797 2/20 0.54
NTSR2 O95665 4/20 0.53
NTSR1 P30989 4/20 0.53
SORT1 Q99523 4/20 0.53
OPRD1 P41143 1/20 0.52

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
SCHEMBL29591171 0.91 SLC6A2 (0.61) SLC6A2OPRM1NTSR2NTSR1SORT1
SCHEMBL29591704 0.91 SLC6A2 (0.67) SLC6A2OPRM1RENNTSR2NTSR1
SCHEMBL29630655 0.91 SLC6A2 (0.61) SLC6A2OPRM1OPRD1
SCHEMBL29488141 0.90 SLC6A2 (0.73) SLC6A2OPRM1RENOPRD1
SCHEMBL31207218 0.89 SLC6A2 (0.69) SLC6A2OPRM1OPRD1
SCHEMBL31676579 0.89 OPRM1 (0.63) SLC6A2OPRM1OPRD1
SCHEMBL29630330 0.89 SLC6A2 (0.63) SLC6A2OPRM1OPRD1
SCHEMBL29591075 0.89 SLC6A2 (0.64) SLC6A2OPRM1NTSR2NTSR1SORT1
SCHEMBL29592716 0.88 SLC6A2 (0.64) SLC6A2OPRM1RENNTSR2NTSR1
SCHEMBL29590367 0.88 SLC6A2 (0.64) SLC6A2OPRM1NTSR2NTSR1OPRD1

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