SCHEMBL31516403

SCHEMBL31516403

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

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 13/20 0.49
▸ SCTR P47872 1/20 0.49
▸ VIPR2 P41587 5/20 0.46
▸ VIPR1 P32241 3/20 0.45
▸ KEAP1 Q14145 1/20 0.43
▸ GCGR P47871 1/20 0.43

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
SCHEMBL29980705 0.89 KEAP1 (0.49) GLP1RSCTRKEAP1GCGR
SCHEMBL31307244 0.87 GLP1R (0.51) GLP1RSCTRVIPR2VIPR1KEAP1
SCHEMBL31366748 0.86 GLP1R (0.51) GLP1RSCTRVIPR2VIPR1
SCHEMBL29526513 0.86 GLP1R (0.57) GLP1RSCTRVIPR2VIPR1
SCHEMBL30645275 0.85 GLP1R (0.44) GLP1RSCTR
SCHEMBL30285520 0.85 NPY4R (0.58) GLP1RSCTR
SCHEMBL29519556 0.85 KISS1R (0.49) GLP1RSCTRVIPR2VIPR1KEAP1
SCHEMBL29367975 0.85 GLP1R (0.44) GLP1RSCTRVIPR2
SCHEMBL30262179 0.85 GLP1R (0.51) GLP1RSCTRVIPR2VIPR1
SCHEMBL29808185 0.85 NPY4R (0.48) GLP1RSCTRVIPR2VIPR1

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
CN-119925563-A Small molecule peptide composition for repairing cerebral apoplexy brain cells based on stem cell targeting 北京钦川科技有限公司 2025-05-06 — — CN disclosed
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