SCHEMBL30974035

SCHEMBL30974035

N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 2/20 0.46
PTGS1 P23219 1/20 0.46
GSTK1 Q9Y2Q3 1/20 0.46
EGFR P00533 1/20 0.40
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
NMT1 P30419 5/20 0.38
NMT2 O60551 4/20 0.38
FOLH1 Q04609 1/20 0.37
RIMKLA Q8IXN7 1/20 0.37
NAALAD2 Q9Y3Q0 1/20 0.37
BMP1 P13497 1/20 0.36
GRM8 O00222 1/20 0.36
GRM6 O15303 1/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GSR P00390 1/20 0.36
CYP1A2 P05177 1/20 0.36
GRIK1 P39086 1/20 0.36

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
SCHEMBL29693286 0.96 GLO1 (0.49) GLO1PTGS1GSTK1EGFRDPP4
SCHEMBL30069089 0.92 GLO1 (0.44) GLO1PTGS1GSTK1EGFRDPP4
SCHEMBL29671487 0.91 PTGS1 (0.46) GLO1PTGS1GSTK1NMT1NMT2
SCHEMBL29499687 0.91 PTGS1 (0.46) GLO1PTGS1GSTK1NMT1NMT2
SCHEMBL31571920 0.91 PTGS1 (0.59) GLO1PTGS1GSTK1EGFRDPP4
SCHEMBL29682736 0.91 GLO1 (0.44) GLO1PTGS1GSTK1EGFRDPP4
SCHEMBL30099639 0.90 GLO1 (0.41) GLO1PTGS1GSTK1EGFRDPP4
SCHEMBL29526446 0.90 PTGS1 (0.52) GLO1PTGS1GSTK1EGFRDPP4
SCHEMBL29671002 0.89 PTGS1 (0.47) GLO1PTGS1GSTK1
SCHEMBL32670710 0.88 PTGS1 (0.54) GLO1PTGS1GSTK1EGFRDPP4

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
WO-2024132725-A1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF INTRACRANIAL HEMORRHAGIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF INTRACRANIAL HEMORRHAGIC STROKE FROM ACUTE ISCHEMIC STROKE UNIWERSYTET GDANSKI (PL) 2024-06-27 WO claimed
WO-2024132726-A1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE UNIWERSYTET GDANSKI (PL) 2024-06-27 WO claimed
WO-2024132726-A1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE UNIWERSYTET GDANSKI (PL) 2024-06-27 WO disclosed