SCHEMBL29973739

SCHEMBL29973739

CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 18/20 0.51
▸ SCTR P47872 1/20 0.51
▸ TFPI P10646 1/20 0.45
▸ KEAP1 Q14145 1/20 0.45

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
SCHEMBL30462284 0.89 GLP1R (0.55) GLP1RSCTRTFPI
SCHEMBL31307238 0.88 GLP1R (0.61) GLP1RSCTR
SCHEMBL30613906 0.87 VIPR2 (0.49) GLP1RKEAP1
SCHEMBL30648447 0.86 GLP1R (0.59) GLP1RSCTR
SCHEMBL30277571 0.86 TFPI (0.58) GLP1RSCTRTFPI
SCHEMBL31410848 0.85 GLP1R (0.62) GLP1RSCTRKEAP1
SCHEMBL30512578 0.85 GLP1R (0.48) GLP1RSCTR
SCHEMBL30524371 0.85 GLP1R (0.56) GLP1RSCTRKEAP1
SCHEMBL31410870 0.85 GLP1R (0.61) GLP1RSCTRKEAP1
SCHEMBL31419696 0.84 GLP1R (0.51) GLP1RSCTRKEAP1

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-4067370-A1 HIGH PENETRATION PRODRUG COMPOSITIONS OF PEPTIDES AND PEPTIDE RELATED COMPOUNDS Yu, Chongxi (US) 2022-10-05 — — EP disclosed
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