SCHEMBL30974254

SCHEMBL30974254

C[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 4/20 0.39
▸ OPRD1 P41143 4/20 0.39
▸ MME P08473 4/20 0.38
▸ CD274 Q9NZQ7 4/20 0.35
▸ PDCD1LG2 Q9BQ51 2/20 0.35
▸ MAGI3 Q5TCQ9 1/20 0.33
▸ VSIR Q9H7M9 3/20 0.33
▸ PDCD1 Q15116 1/20 0.32
▸ ECE1 P42892 1/20 0.32
▸ OPRK1 P41145 1/20 0.32

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
SCHEMBL29530913 0.96 MME (0.40) OPRM1OPRD1MMECD274PDCD1LG2
SCHEMBL30974040 0.91 OPRM1 (0.42) OPRM1OPRD1MMECD274PDCD1LG2
SCHEMBL30116291 0.89 MME (0.38) MMEECE1
SCHEMBL31453800 0.88 OPRM1 (0.40) OPRM1OPRD1MMECD274PDCD1LG2
SCHEMBL30974036 0.88 SLC15A2 (0.38) OPRM1OPRD1MMECD274PDCD1LG2
SCHEMBL5526723 0.87 OPRM1 (0.42) OPRM1OPRD1MME
SCHEMBL4935995 0.87 OPRM1 (0.42) OPRM1OPRD1MME
SCHEMBL29590364 0.87 OPRM1 (0.39) OPRM1OPRD1MAGI3OPRK1
SCHEMBL30254475 0.86 OPRM1 (0.39) OPRM1OPRD1MMECD274PDCD1LG2
SCHEMBL29849128 0.86 MME (0.36) MMEECE1

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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