SCHEMBL29630726

SCHEMBL29630726

N=C(N)NCCC[C@H](N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 8/20 0.51
OPRM1 P35372 7/20 0.51
OPRK1 P41145 2/20 0.51
NPY4R P50391 8/20 0.47
NPY1R P25929 5/20 0.47
NPY2R P49146 4/20 0.47
NPY5R Q15761 4/20 0.47

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
SCHEMBL31122216 0.98 OPRD1 (0.49) OPRD1OPRM1OPRK1NPY4RNPY1R
SCHEMBL29592541 0.93 OPRD1 (0.49) OPRD1OPRM1OPRK1NPY4RNPY1R
SCHEMBL29590346 0.92 OPRD1 (0.49) OPRD1OPRM1OPRK1NPY4RNPY1R
SCHEMBL29592498 0.92 OPRD1 (0.49) OPRD1OPRM1OPRK1NPY4RNPY1R
SCHEMBL29630731 0.92 OPRD1 (0.51) OPRD1OPRM1OPRK1
SCHEMBL28848545 0.92 NPY4R (0.55) OPRD1OPRM1OPRK1NPY4RNPY1R
SCHEMBL31637483 0.91 NPY4R (0.49) OPRD1OPRM1OPRK1NPY4RNPY1R
SCHEMBL29865541 0.91 NPY4R (0.49) OPRD1OPRM1OPRK1NPY4RNPY1R
SCHEMBL29590476 0.91 QRFPR (0.51) OPRD1OPRM1OPRK1NPY4RNPY1R
SCHEMBL29591812 0.91 OPRD1 (0.62) OPRD1OPRM1OPRK1NPY4RNPY1R

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