SCHEMBL4210069

SCHEMBL4210069

NCC(=O)OC(=O)CC(O)C(=O)OC(=O)CN.[Mn].[Mn]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL28094830 0.98
SCHEMBL4210612 0.96
SCHEMBL4210451 0.96
SCHEMBL4929943 0.81 SMN1; SMN2 (0.46)
SCHEMBL27814945 0.78 NAAA (0.39)
SCHEMBL2036591 0.78 SMN1; SMN2 (0.48)
SCHEMBL5202579 0.78
SCHEMBL30250124 0.78 OR51E2 (0.39)
SCHEMBL29186681 0.77 MMP1 (0.39)
SCHEMBL5519310 0.77 TSHR (0.36)

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
US-20090209642-A1 Hydroxy Acid Complexes for Antiaging and Skin Renovation BIODERM RESEARCH (US) 2009-08-20 US claimed