SCHEMBL30974290

SCHEMBL30974290

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ENPEP Q07075 16/20 0.51
▸ GRIN2D O15399 1/20 0.48
▸ GRIN3B O60391 1/20 0.48
▸ GRIN1 Q05586 1/20 0.48
▸ GRIN2A Q12879 1/20 0.48
▸ GRIN2B Q13224 1/20 0.48
▸ GRIN2C Q14957 1/20 0.48
▸ GRIN3A Q8TCU5 1/20 0.48
▸ TASP1 Q9H6P5 1/20 0.47
▸ BACE1 P56817 1/20 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
SCHEMBL30974505 0.92 GRIN2D (0.53) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29919624 0.90 BACE1 (0.54) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30974262 0.90 BACE1 (0.54) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8976222 0.89 GRIN2D (0.55) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8976242 0.89 GRIN2D (0.55) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30578947 0.89 BACE1 (0.52) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29362623 0.89 BACE1 (0.49) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31554818 0.88 GRIN2D (0.53) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30959074 0.88 ENPEP (0.52) ENPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30365494 0.88 GRIN2D (0.53) ENPEPGRIN2DGRIN3BGRIN1GRIN2A

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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