SCHEMBL30596285

SCHEMBL30596285

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

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 9/20 0.53
CTSC P53634 1/20 0.46
BACE1 P56817 5/20 0.46
NAALAD2 Q9Y3Q0 1/20 0.43
ERAP2 Q6P179 1/20 0.43

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
SCHEMBL30903472 0.94 FOLH1 (0.60) FOLH1CTSCBACE1NAALAD2ERAP2
SCHEMBL30974391 0.94 CTSC (0.51) FOLH1CTSCBACE1NAALAD2
SCHEMBL31415962 0.93 FOLH1 (0.49) FOLH1CTSCBACE1ERAP2
SCHEMBL30596291 0.93 FOLH1 (0.53) FOLH1CTSCBACE1NAALAD2ERAP2
SCHEMBL30878077 0.92 FOLH1 (0.58) FOLH1CTSCBACE1NAALAD2ERAP2
SCHEMBL1370322 0.92 FOLH1 (0.51) FOLH1CTSCBACE1ERAP2
SCHEMBL1370314 0.92 FOLH1 (0.51) FOLH1CTSCBACE1ERAP2
SCHEMBL29531987 0.91 FOLH1 (0.60) FOLH1CTSCBACE1NAALAD2ERAP2
SCHEMBL30193535 0.91 FOLH1 (0.60) FOLH1CTSCBACE1NAALAD2ERAP2
SCHEMBL29630326 0.90 FOLH1 (0.56) FOLH1CTSCBACE1NAALAD2ERAP2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116836223-B Prinsepia utilis royle active peptide composition and new application thereof 昆明理工大学 2024-10-25 CN claimed
CN-116836223-B Prinsepia utilis royle active peptide composition and new application thereof 昆明理工大学 2024-10-25 CN disclosed
CN-116836223-A Prinsepia utilis royle active peptide composition and new application thereof 昆明理工大学 2023-10-03 CN disclosed