Sugi Predict

Sugi Predict / Compounds / SCHEMBL30836804

SCHEMBL30836804

SCHEMBL30836804

C[C@H](NC(=O)[C@H](Cc1cn(C(=O)OC(C)(C)C)cn1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 9/20 0.42
▸ OPRD1 P41143 6/20 0.39
▸ CCKBR P32239 5/20 0.39
▸ CCKAR P32238 5/20 0.39

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
SCHEMBL34463366 0.91 REN (0.38) RENOPRD1CCKBRCCKAR
SCHEMBL30437952 0.88 REN (0.40) RENOPRD1CCKBRCCKAR
SCHEMBL31614440 0.86 REN (0.41) RENOPRD1CCKBRCCKAR
SCHEMBL30863518 0.84 PSEN1 (0.39) RENOPRD1
SCHEMBL29554598 0.84 REN (0.37) RENOPRD1CCKBRCCKAR
SCHEMBL30107533 0.83 REN (0.41) REN
SCHEMBL31088668 0.82 REN (0.36) RENOPRD1CCKBRCCKAR
SCHEMBL34461946 0.82 REN (0.39) RENOPRD1CCKBRCCKAR
SCHEMBL30438040 0.82 GLP1R (0.38) RENOPRD1
SCHEMBL30096878 0.82 REN (0.37) RENOPRD1CCKBRCCKAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4345104-B1 METHOD FOR PREPARING LIRAGLUTIDE BACHEM HOLDING AG (CH) 2024-08-28 — — EP disclosed
WO-2024068827-A1 METHOD FOR PREPARING LIRAGLUTIDE BACHEM HOLDING AG (CH) 2024-04-04 — — WO disclosed
EP-4345104-A1 METHOD FOR PREPARING LIRAGLUTIDE Bachem Holding AG (CH) 2024-04-03 — — EP disclosed
Send feedback