SCHEMBL31410890

SCHEMBL31410890

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

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 17/20 0.58
▸ VIPR1 P32241 1/20 0.56
▸ PTH1R Q03431 1/20 0.54
▸ SCTR P47872 1/20 0.54

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
SCHEMBL31410887 0.97 GLP1R (0.57) GLP1RVIPR1SCTR
SCHEMBL31307289 0.96 GLP1R (0.60) GLP1RVIPR1PTH1RSCTR
SCHEMBL31410870 0.93 GLP1R (0.61) GLP1RSCTR
SCHEMBL31410848 0.93 GLP1R (0.62) GLP1RSCTR
SCHEMBL30477260 0.93 GLP1R (0.59) GLP1RVIPR1SCTR
SCHEMBL30168701 0.92 PTH1R (0.53) GLP1RVIPR1PTH1R
SCHEMBL30168752 0.92 GLP1R (0.52) GLP1RVIPR1PTH1RSCTR
SCHEMBL29836426 0.91 PTH1R (0.53) GLP1RPTH1R
SCHEMBL30432055 0.91 CALCR (0.59) GLP1RPTH1R
SCHEMBL29836354 0.91 GLP1R (0.51) GLP1RVIPR1PTH1R

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
WO-2025002589-A1 TISSUE EXTRACELLULAR PEPTIDE PATTERNS DEDICATED FOR GENERATION OF ANTI-CANCER VACCINES AGAINST SALIVARY GLAND TUMOR, IDENTIFICATION AND ISOLATION OF SALIVARY GLAND TUMOR SPECIFIC T CELLS IN HUMANS Uniwersytet Gdański (PL) 2025-01-02 — — WO disclosed
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