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SCHEMBL31307236

SCHEMBL31307236

CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CN)C(C)C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.57
▸ GLP1R P43220 9/20 0.54
▸ SCTR P47872 1/20 0.54
▸ CALCR P30988 3/20 0.52
▸ GCGR P47871 4/20 0.52
▸ GIPR P48546 1/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.51
▸ ITGB3 P05106 1/20 0.51
▸ ITGAV P06756 1/20 0.51

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
SCHEMBL31410833 0.96 TFPI (0.56) TFPIGLP1RSCTRCALCRGCGR
SCHEMBL31182575 0.91 TFPI (0.63) TFPIGLP1RSCTRCALCRGCGR
SCHEMBL30424730 0.91 C5AR1 (0.53) TFPIGLP1RSCTRCALCRGCGR
SCHEMBL30567739 0.89 TFPI (0.56) TFPIGLP1RSCTRCALCRGCGR
SCHEMBL29697191 0.87 NPY4R (0.51) TFPIGLP1RSCTRCALCRGCGR
SCHEMBL30658366 0.87 CALCR (0.60) GLP1RCALCRRXFP1
SCHEMBL29964276 0.87 TFPI (0.57) TFPIGLP1RSCTR
SCHEMBL29965054 0.87 NPY4R (0.56) TFPIGLP1RSCTRGCGR
SCHEMBL30883206 0.87 TFPI (0.61) TFPIGLP1RSCTRCALCRGCGR
SCHEMBL30495831 0.86 VIPR2 (0.57) GLP1RCALCRGCGRGIPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4484442-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 Gdanski (PL) 2025-01-01 — — EP claimed
EP-4484442-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 Gdanski (PL) 2025-01-01 — — EP disclosed
EP-4484955-A1 METHOD FOR SCREENING OF EXTRACELLULAR TISSUE PEPTIDES IN MAMMALIAN TISSUE SAMPLES FOR HEALTH STATUS EVALUATION, DISEASE DIAGNOSTICS AND NEOANTIGEN DISCOVERY Uniwersytet Gdanski (PL) 2025-01-01 — — EP disclosed
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