SCHEMBL30814697

SCHEMBL30814697

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

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 10/20 0.48
MME P08473 2/20 0.48
CTSD P07339 2/20 0.47
BACE2 Q9Y5Z0 2/20 0.47
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.45
LAP3 P28838 2/20 0.44

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
SCHEMBL31666009 0.97 BACE1 (0.50) BACE1MMECTSDBACE2
SCHEMBL30876809 0.93 BACE1 (0.52) BACE1MMECTSDBACE2
SCHEMBL28586132 0.93 ALDH1A1 (0.50) BACE1MMECTSDBACE2ALDH1A1
SCHEMBL28586133 0.93 ALDH1A1 (0.50) BACE1MMECTSDBACE2ALDH1A1
SCHEMBL30837136 0.92 BACE1 (0.53) BACE1CTSDBACE2
SCHEMBL29880484 0.91 BACE1 (0.48) BACE1MMECTSDBACE2
SCHEMBL3783630 0.91 MME (0.55) MMEALDH1A1MAPTLAP3
SCHEMBL31234069 0.91 MME (0.55) MMEALDH1A1MAPTLAP3
SCHEMBL3783635 0.91 MME (0.55) MMEALDH1A1MAPTLAP3
SCHEMBL30494645 0.91 MME (0.55) MMEALDH1A1MAPTLAP3

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
CN-117586343-A Umami tripeptide and umami polypeptide composition as well as preparation methods and applications thereof 湖南农业大学 2024-02-23 CN disclosed