SCHEMBL30973975

SCHEMBL30973975

NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 1/20 0.54
▸ LNPEP Q9UIQ6 1/20 0.54
▸ NPY4R P50391 4/20 0.53
▸ NPY1R P25929 3/20 0.53
▸ NPY2R P49146 3/20 0.53
▸ ENPEP Q07075 2/20 0.50
▸ NTSR2 O95665 2/20 0.47
▸ NTSR1 P30989 2/20 0.47
▸ CHRNA1 P02708 1/20 0.47
▸ CHRNG P07510 1/20 0.47
▸ CHRNB1 P11230 1/20 0.47
▸ CHRND Q07001 1/20 0.47
▸ NPY5R Q15761 2/20 0.46

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
SCHEMBL31031465 1.00 ERAP2 (0.54) ERAP2LNPEPNPY4RNPY1RNPY2R
SCHEMBL31135152 0.98 ERAP2 (0.56) ERAP2LNPEPNPY4RNPY1RNPY2R
SCHEMBL30263672 0.98 ERAP2 (0.56) ERAP2LNPEPNPY4RNPY1RNPY2R
SCHEMBL30974367 0.96 NPY4R (0.58) ERAP2LNPEPNPY4RNPY1RNPY2R
SCHEMBL30861727 0.93 LNPEP (0.61) ERAP2LNPEPNPY4RNPY1RNPY2R
SCHEMBL29680070 0.92 NPY1R (0.56) ERAP2LNPEPNPY4RNPY1RNPY2R
SCHEMBL29349759 0.91 NPY4R (0.57) ERAP2LNPEPNPY4RNPY1RNPY2R
Lysyl-Tyrosyl-Lysine Acetate SCHEMBL6275116 0.91 NPY4R (0.62) ERAP2LNPEPNPY4RNPY1RNPY2R
Lysyl-Tyrosyl-Lysine Acetate SCHEMBL6275111 0.91 NPY4R (0.62) ERAP2LNPEPNPY4RNPY1RNPY2R
SCHEMBL30523264 0.91 LNPEP (0.63) ERAP2LNPEPNPY4RNPY1RNPY2R

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-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
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