SCHEMBL30974076

SCHEMBL30974076

C[C@@H](O)[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.47
▸ REN P00797 1/20 0.47
▸ RAMP3 O60896 12/20 0.42
▸ CALCR P30988 12/20 0.42
▸ OPRM1 P35372 2/20 0.39
▸ OPRK1 P41145 2/20 0.39
▸ CTSL P07711 1/20 0.39
▸ CTSH P09668 1/20 0.39
▸ CTSS P25774 1/20 0.39
▸ CTSK P43235 1/20 0.39
▸ EPHA2 P29317 2/20 0.39
▸ CXCR4 P61073 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
SCHEMBL31437158 0.88 ACE (0.43) ACERENOPRM1OPRK1EPHA2
SCHEMBL30471913 0.87 OPRM1 (0.48) ACEOPRM1OPRK1CXCR4
SCHEMBL31344445 0.86 KEAP1 (0.51) RAMP3CALCR
SCHEMBL31410879 0.86 NPY2R (0.47) RAMP3CALCREPHA2
SCHEMBL30909415 0.86 ACE (0.44) ACERENOPRM1OPRK1CXCR4
SCHEMBL29994788 0.85 OPRK1 (0.46) ACEOPRM1OPRK1CXCR4
SCHEMBL29411971 0.85 OPRK1 (0.46) ACEOPRM1OPRK1CXCR4
SCHEMBL29575914 0.85 RAMP3 (0.50) RAMP3CALCR
SCHEMBL30443975 0.85 ACE (0.45) ACERENRAMP3CALCREPHA2
SCHEMBL29839542 0.84 RAMP3 (0.57) RAMP3CALCROPRM1OPRK1

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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