SCHEMBL31246306

SCHEMBL31246306

CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@](C)(CC)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(C)(C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C)(C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)C(C)C

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 19/20 0.72
CCKBR P32239 2/20 0.72
GIPR P48546 18/20 0.69
GCGR P47871 7/20 0.69

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
SCHEMBL31246294 1.00 GLP1R (0.72) GLP1RCCKBRGIPRGCGR
SCHEMBL31246305 0.97 GLP1R (0.75) GLP1RCCKBRGIPRGCGR
SCHEMBL31246274 0.97 GLP1R (0.69) GLP1RCCKBRGIPRGCGR
SCHEMBL31246278 0.97 GLP1R (0.69) GLP1RCCKBRGIPRGCGR
SCHEMBL31246303 0.97 GLP1R (0.77) GLP1RCCKBRGIPRGCGR
SCHEMBL31246276 0.95 GIPR (0.75) GLP1RGIPRGCGR
SCHEMBL31246279 0.95 GLP1R (0.71) GLP1RCCKBRGIPRGCGR
SCHEMBL31246277 0.94 GLP1R (0.74) GLP1RCCKBRGIPRGCGR
SCHEMBL31246299 0.91 GLP1R (0.79) GLP1RCCKBRGIPR
SCHEMBL31246284 0.91 GLP1R (0.79) GLP1RCCKBRGIPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3601329-B1 GIP RECEPTOR ACTIVATING PEPTIDE TAKEDA PHARMACEUTICALS CO (JP) 2024-12-04 EP disclosed