SCHEMBL31270648

SCHEMBL31270648

CC(C)(C)OC(=O)NCC(=O)N[C@@H](Cc1cn(C(=O)OC(C)(C)C)cn1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.41
CPB2 Q96IY4 7/20 0.40
CPB1 P15086 1/20 0.39
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
YAP1 P46937 1/20 0.36
MAPK1 P28482 1/20 0.35
PTPRB P23467 1/20 0.35
ITGA4 P13612 1/20 0.35
ITGB7 P26010 1/20 0.35
PTPN1 P18031 1/20 0.35

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
SCHEMBL18207142 0.90 ACE (0.44) ACECPB2CPB1ITGB3ITGA2B
SCHEMBL23397828 0.90 ACE (0.44) ACECPB2CPB1ITGB3ITGA2B
SCHEMBL3008889 0.89 ITGB3 (0.45) ACECPB2CPB1ITGB3ITGA2B
SCHEMBL3008885 0.89 ITGB3 (0.45) ACECPB2CPB1ITGB3ITGA2B
SCHEMBL13650201 0.89 ITGB3 (0.45) ACECPB2CPB1ITGB3ITGA2B
Benzene SCHEMBL29402026 0.88 ACE (0.47) ACECPB2CPB1ITGB3ITGA2B
SCHEMBL31270834 0.88 MEN1 (0.40) PTPN1
SCHEMBL18218810 0.85 CPB2 (0.45) ACECPB2CPB1ITGB3ITGA2B
SCHEMBL10659919 0.82 CPB2 (0.46) CPB2CPB1
SCHEMBL29398206 0.81 MAPK1 (0.42) ACECPB2CPB1ITGB3ITGA2B

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-119060121-B Synthesis method of oligopeptide-1 山东美欣生物科技有限公司 2025-03-14 CN disclosed
CN-119060121-A Synthesis process of oligopeptide-1 山东美欣生物科技有限公司 2024-12-03 CN disclosed