SCHEMBL29728076

SCHEMBL29728076

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

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 11/20 0.48
▸ CTSD P07339 4/20 0.48
▸ PDCD1LG2 Q9BQ51 1/20 0.48
▸ CD274 Q9NZQ7 1/20 0.48
▸ OPRD1 P41143 1/20 0.42
▸ ENPEP Q07075 5/20 0.41
▸ BACE2 Q9Y5Z0 1/20 0.40

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
SCHEMBL30390119 0.92 CD274 (0.55) BACE1CTSDPDCD1LG2CD274ENPEP
SCHEMBL29697048 0.91 CD274 (0.49) BACE1CTSDPDCD1LG2CD274
SCHEMBL31319517 0.90 BACE1 (0.49) BACE1CTSDPDCD1LG2CD274OPRD1
SCHEMBL29420865 0.89 BACE1 (0.53) BACE1CTSDPDCD1LG2CD274ENPEP
SCHEMBL29728075 0.89 BACE1 (0.52) BACE1CTSDPDCD1LG2CD274OPRD1
SCHEMBL30271497 0.87 ENPEP (0.44) BACE1CTSDPDCD1LG2CD274ENPEP
SCHEMBL30390484 0.87 CD274 (0.61) BACE1CTSDPDCD1LG2CD274
SCHEMBL31181173 0.87 ENPEP (0.44) BACE1CTSDOPRD1ENPEPBACE2
SCHEMBL30538341 0.85 ECE1 (0.50) BACE1CTSDENPEP
SCHEMBL30390006 0.85 CD274 (0.52) BACE1CTSDPDCD1LG2CD274

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-114874995-A Classical swine fever virus type 2E rns Monoclonal antibody hybridoma cell strain of protein and application 浙江大学 2022-08-09 — — CN claimed
CN-114874995-B Swine fever virus 2E rns Monoclonal antibody hybridoma cell strain of protein and application 浙江大学 2024-03-22 — — CN disclosed
CN-114874995-A Classical swine fever virus type 2E rns Monoclonal antibody hybridoma cell strain of protein and application 浙江大学 2022-08-09 — — CN disclosed
Send feedback