SCHEMBL31663833

SCHEMBL31663833

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

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 7/20 0.49
▸ MAGI3 Q5TCQ9 1/20 0.44
▸ GLP1R P43220 6/20 0.43
▸ CTSD P07339 1/20 0.41
▸ ERBB2 P04626 1/20 0.41

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
SCHEMBL31031619 0.91 GLP1R (0.51) GLP1R
SCHEMBL29771459 0.89 BACE1 (0.41) BACE1MAGI3GLP1R
SCHEMBL29624554 0.89 BACE1 (0.43) BACE1MAGI3GLP1R
SCHEMBL31257072 0.89 MAGI3 (0.48) BACE1MAGI3GLP1R
SCHEMBL30831910 0.88 BACE1 (0.45) BACE1MAGI3GLP1R
SCHEMBL31031462 0.88 BACE1 (0.42) BACE1CTSDERBB2
SCHEMBL30919404 0.88 BACE1 (0.41) BACE1GLP1RCTSDERBB2
SCHEMBL29994497 0.86 BACE1 (0.48) BACE1GLP1RCTSD
SCHEMBL31420016 0.86 ENPEP (0.47) BACE1
SCHEMBL31256975 0.85 BACE1 (0.42) BACE1GLP1RCTSD

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
EP-4390398-B1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF INTRACRANIAL HEMORRHAGIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF INTRACRANIAL HEMORRHAGIC STROKE FROM ACUTE ISCHEMIC STROKE UNIV GDANSKI (PL) 2025-07-23 — — EP disclosed
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