SCHEMBL30974352

SCHEMBL30974352

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nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 4/20 0.57
PDCD1LG2 Q9BQ51 2/20 0.57
ECE1 P42892 3/20 0.44
VSIR Q9H7M9 3/20 0.44
BACE1 P56817 5/20 0.41
CTSD P07339 2/20 0.41
PDCD1 Q15116 1/20 0.40
CTSC P53634 1/20 0.39
MME P08473 1/20 0.37

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
SCHEMBL29658150 0.93 CD274 (0.52) CD274PDCD1LG2ECE1VSIRBACE1
SCHEMBL29697180 0.93 PDCD1LG2 (0.50) CD274PDCD1LG2ECE1VSIRBACE1
SCHEMBL30903445 0.92 CD274 (0.51) CD274PDCD1LG2ECE1VSIRBACE1
SCHEMBL5985374 0.90 CD274 (0.54) CD274PDCD1LG2ECE1VSIRBACE1
SCHEMBL5985386 0.90 CD274 (0.54) CD274PDCD1LG2ECE1VSIRBACE1
SCHEMBL30006789 0.90 CD274 (0.55) CD274PDCD1LG2ECE1VSIRBACE1
SCHEMBL29630814 0.88 ECE1 (0.51) CD274PDCD1LG2ECE1VSIRBACE1
SCHEMBL30390484 0.88 CD274 (0.61) CD274PDCD1LG2ECE1VSIRBACE1
SCHEMBL30712169 0.87 BACE1 (0.47) CD274PDCD1LG2ECE1BACE1CTSD
SCHEMBL29434591 0.86 ECE1 (0.58) CD274PDCD1LG2ECE1VSIRCTSC

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