SCHEMBL31246283

SCHEMBL31246283

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=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

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GIPR P48546 20/20 0.66
GLP1R P43220 19/20 0.66
GCGR P47871 7/20 0.65

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
SCHEMBL31246276 0.90 GIPR (0.75) GIPRGLP1RGCGR
SCHEMBL24796457 0.89 GLP1R (0.69) GIPRGLP1RGCGR
SCHEMBL30647296 0.88 GLP1R (0.70) GIPRGLP1RGCGR
SCHEMBL31703183 0.88 GLP1R (0.69) GIPRGLP1RGCGR
SCHEMBL24796449 0.88 GIPR (0.73) GIPRGLP1RGCGR
SCHEMBL30647310 0.87 GLP1R (0.65) GIPRGLP1RGCGR
SCHEMBL30647305 0.87 GLP1R (0.65) GIPRGLP1RGCGR
SCHEMBL30647309 0.87 GLP1R (0.66) GIPRGLP1RGCGR
SCHEMBL30310773 0.86 GLP1R (0.67) GIPRGLP1RGCGR
SCHEMBL31246279 0.86 GLP1R (0.71) GIPRGLP1RGCGR

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