SCHEMBL30454933

SCHEMBL30454933

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

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
MME P08473 3/20 0.46
LAP3 P28838 3/20 0.46
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
KMT2A Q03164 1/20 0.45
BACE1 P56817 6/20 0.44
CTSD P07339 1/20 0.43
MAPT P10636 1/20 0.43
LTA4H P09960 1/20 0.42
BACE2 Q9Y5Z0 1/20 0.41
FOLH1 Q04609 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
SCHEMBL29531317 1.00 ALDH1A1 (0.47) ALDH1A1MMELAP3MEN1LMNA
SCHEMBL29887755 0.97 BACE1 (0.47) ALDH1A1MMELAP3MEN1LMNA
SCHEMBL31741318 0.95 BACE1 (0.47) ALDH1A1MMEBACE1CTSDBACE2
SCHEMBL30262167 0.92 FNTA (0.43) ALDH1A1MMELAP3BACE1CTSD
SCHEMBL28586132 0.91 ALDH1A1 (0.50) ALDH1A1MMELAP3MEN1LMNA
SCHEMBL28586133 0.91 ALDH1A1 (0.50) ALDH1A1MMELAP3MEN1LMNA
SCHEMBL3777970 0.91 ALDH1A1 (0.56) ALDH1A1MMELAP3MEN1LMNA
SCHEMBL3777968 0.91 ALDH1A1 (0.56) ALDH1A1MMELAP3MEN1LMNA
SCHEMBL30676222 0.91 ALDH1A1 (0.56) ALDH1A1MMELAP3MEN1LMNA
SCHEMBL30381706 0.90 PDCD1LG2 (0.47) ALDH1A1MMELAP3MEN1LMNA

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-2023120844-A1 COMPOSITION FOR MASS PROLIFERATING NATURAL KILLER CELLS, COMPRISING NOVEL PEPTIDE, AND METHOD FOR MASS PROLIFERATING NATURAL KILLER CELLS BY USING SAME 엔케이젠 주식회사 2023-06-29 WO claimed