SCHEMBL4285379

SCHEMBL4285379

CC(N)OC(N)CC(O)(CO)CC(N)OC(C)N

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
SCHEMBL9067075 0.74 FDPS (0.44)
SCHEMBL6744672 0.71
SCHEMBL4289918 0.69
Ethylene Glycol SCHEMBL8823004 0.65 TSHR (0.33)
SCHEMBL10436477 0.63
SCHEMBL14750408 0.63 TSHR (0.39)
SCHEMBL28230813 0.61 TDP1 (0.42)
SCHEMBL8330698 0.59
SCHEMBL55913 0.59
SCHEMBL15044049 0.59 TSHR (0.38)

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
US-20090162917-A1 Subtilism Carlsberg Proteins With Reduced Immunogencity HARDING FIONA A 2009-06-25 US disclosed
US-20040235173-A1 Recovering cell which has been multiply transduced with vectors comprising distinct heterologous sequences; bioreactor which expresses multiple exogenous proteins GALA DESIGN, INC. 2004-11-25 US disclosed