SCHEMBL30974390

SCHEMBL30974390

N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 10/20 0.44
▸ NPY1R P25929 5/20 0.44
▸ NPY2R P49146 4/20 0.44
▸ NPY5R Q15761 4/20 0.44
▸ C5AR1 P21730 1/20 0.43
▸ MC4R P32245 1/20 0.41
▸ SLC15A2 Q16348 1/20 0.40
▸ FOLH1 Q04609 1/20 0.40
▸ TUBB4A P04350 1/20 0.39
▸ TUBB P07437 1/20 0.39
▸ TUBA3C P0DPH7 1/20 0.39
▸ TUBA1B P68363 1/20 0.39
▸ TUBA4A P68366 1/20 0.39
▸ TUBB4B P68371 1/20 0.39
▸ TUBB3 Q13509 1/20 0.39
▸ TUBB2A Q13885 1/20 0.39
▸ TUBB8 Q3ZCM7 1/20 0.39
▸ TUBA3E Q6PEY2 1/20 0.39
▸ TUBA1A Q71U36 1/20 0.39
▸ TUBA1C Q9BQE3 1/20 0.39

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
SCHEMBL29638851 0.96 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL29653698 0.96 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL29754443 0.96 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL29754546 0.96 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL30525431 0.96 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL29542887 0.96 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL30947692 0.96 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL29653774 0.96 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL31314316 0.95 FOLH1 (0.41) NPY4RNPY1RNPY2RNPY5RC5AR1
SCHEMBL30277081 0.95 FOLH1 (0.41) NPY4RNPY1RNPY2RNPY5RC5AR1

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 disclosed
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