SCHEMBL30477366

SCHEMBL30477366

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

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.58
GRIN2D O15399 1/20 0.49
GRIN3B O60391 1/20 0.49
GRIN1 Q05586 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49
GRIN3A Q8TCU5 1/20 0.49
ENPEP Q07075 5/20 0.48
TASP1 Q9H6P5 1/20 0.46
VIPR2 P41587 3/20 0.46
VIPR1 P32241 1/20 0.46

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
SCHEMBL29919624 0.97 BACE1 (0.54) BACE1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL31346757 0.96 BACE1 (0.55) BACE1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30512610 0.94 BACE1 (0.55) BACE1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30578947 0.94 BACE1 (0.52) BACE1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29760983 0.92 BACE1 (0.48) BACE1
SCHEMBL31042502 0.92 BACE1 (0.48) BACE1
SCHEMBL31750957 0.92 BACE1 (0.48) BACE1
SCHEMBL31614422 0.91 BACE1 (0.52) BACE1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL10590691 0.90 ENPEP (0.53) BACE1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30182817 0.90 BACE1 (0.58) BACE1GRIN2DGRIN3BGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111320683-B Tilappa peptide analogue 成都奥达生物科技有限公司 2023-06-27 CN claimed
CN-111320683-B Tilappa peptide analogue 成都奥达生物科技有限公司 2023-06-27 CN disclosed