SCHEMBL30974205

SCHEMBL30974205

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

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.47
ALDH1A1 P00352 2/20 0.45
LAP3 P28838 3/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
MAPT P10636 1/20 0.41
LTA4H P09960 1/20 0.40
FOLH1 Q04609 2/20 0.39

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
SCHEMBL29389695 0.93 MME (0.48) MMEALDH1A1LAP3MEN1LMNA
SCHEMBL30455162 0.93 MME (0.48) MMEALDH1A1LAP3MEN1LMNA
SCHEMBL30453786 0.91 ALDH1A1 (0.53) MMEALDH1A1LAP3MEN1LMNA
SCHEMBL29449455 0.90 MME (0.56) MMEALDH1A1LAP3MEN1LMNA
SCHEMBL30555615 0.90 MME (0.45) MME
SCHEMBL30739544 0.89 OPRD1 (0.54) MMEOPRM1OPRD1OPRK1
SCHEMBL29777890 0.89 MME (0.49) MMEALDH1A1LAP3MEN1LMNA
SCHEMBL29516877 0.89 MME (0.52) MMEALDH1A1LAP3OPRM1OPRD1
SCHEMBL31447481 0.88 MME (0.44) MMEALDH1A1LAP3MEN1LMNA
SCHEMBL29679571 0.88 ALDH1A1 (0.50) MMEALDH1A1LAP3MEN1LMNA

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