SCHEMBL30974462

SCHEMBL30974462

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 1/20 0.41
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ REN P00797 1/20 0.37
▸ BACE1 P56817 3/20 0.37
▸ CTSD P07339 1/20 0.37
▸ MME P08473 3/20 0.36
▸ FNTA P49354 1/20 0.36
▸ FNTB P49356 1/20 0.36
▸ CTSB P07858 1/20 0.35
▸ CALCRL Q16602 1/20 0.35
▸ PRCP P42785 1/20 0.35

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
SCHEMBL29590422 0.88 OPRM1 (0.42) RENBACE1CTSDCALCRL
SCHEMBL29926499 0.87 CALCRL (0.41) TERTRENBACE1CTSDCTSB
SCHEMBL31518654 0.85 TERT (0.42) TERTMEN1KMT2ARENCALCRL
SCHEMBL30417335 0.84 MEN1 (0.41) MEN1KMT2ARENBACE1CALCRL
SCHEMBL30447334 0.84 MME (0.45) MEN1KMT2ARENMME
SCHEMBL29643353 0.83 REN (0.41) MEN1KMT2ARENCALCRL
SCHEMBL30487458 0.82 TERT (0.51) TERTMEN1KMT2APRCP
SCHEMBL29570472 0.82 TERT (0.51) TERTMEN1KMT2APRCP
SCHEMBL30099495 0.82 MEN1 (0.41) TERTMEN1KMT2ARENMME
SCHEMBL29388130 0.82 TERT (0.41) TERTMEN1KMT2ARENBACE1

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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