SCHEMBL30567442

SCHEMBL30567442

NC(=O)CC[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 5/20 0.57
▸ GNPAT O15228 1/20 0.46
▸ BACE1 P56817 1/20 0.45
▸ ANPEP P15144 2/20 0.45

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
SCHEMBL29889128 0.93 MME (0.50) MMEGNPATBACE1
SCHEMBL29634903 0.93 MME (0.50) MMEGNPATBACE1
SCHEMBL29725302 0.90 BACE1 (0.54) MMEGNPATBACE1
SCHEMBL30123399 0.90 MME (0.51) MMEGNPATBACE1
SCHEMBL8821945 0.89 MME (0.55) MMEGNPATBACE1
SCHEMBL29381316 0.89 MME (0.55) MMEGNPATBACE1
SCHEMBL29379648 0.86 FNTA (0.53) MMEGNPAT
SCHEMBL29380396 0.86 FNTA (0.53) MMEGNPAT
SCHEMBL31474554 0.86 BACE1 (0.56) MMEGNPATBACE1
SCHEMBL30567413 0.86 MME (0.67) MME

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-116789734-A Oligopeptide group extracted from crayfish shells, extraction method and application thereof 奇明达(北京)植物药物技术开发有限公司 2023-09-22 — — CN disclosed
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