SCHEMBL30567409

SCHEMBL30567409

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

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.41
NMT2 O60551 1/20 0.40
NMT1 P30419 1/20 0.40
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
GSR P00390 1/20 0.38
FURIN P09958 1/20 0.37
TLR2 O60603 1/20 0.37
CPB2 Q96IY4 1/20 0.36

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
SCHEMBL31472967 0.96 DPP8 (0.39) ACENMT2NMT1DPP8DPP9
SCHEMBL29404549 0.94 ACE (0.46) ACEDPP8DPP9DPP7GSR
SCHEMBL29527624 0.93 ACE (0.43) ACEDPP8DPP9DPP7GSR
SCHEMBL28453993 0.91 GSR (0.44) NMT2NMT1DPP8DPP9DPP7
SCHEMBL28453999 0.91 GSR (0.44) NMT2NMT1DPP8DPP9DPP7
SCHEMBL29551013 0.90 NMT2 (0.43) NMT2NMT1TLR2
SCHEMBL827833 0.90 NMT2 (0.45) NMT2NMT1DPP8DPP9DPP7
SCHEMBL28382531 0.90 NMT2 (0.45) NMT2NMT1DPP8DPP9DPP7
SCHEMBL827832 0.90 NMT2 (0.45) NMT2NMT1DPP8DPP9DPP7
SCHEMBL28382528 0.90 NMT2 (0.45) NMT2NMT1DPP8DPP9DPP7

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-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 claimed
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
CN-116769860-A Enzymatic hydrolysis of crayfish shells, oligopeptide family extracted from crayfish shells and application of crayfish shells 奇明达(北京)植物药物技术开发有限公司 2023-09-19 CN disclosed