SCHEMBL14217635

SCHEMBL14217635

C[C@@H](CN)OC(CO)[C@@H](O)CO

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL15450712 0.84 TDP1 (0.36) TDP1LMNAL3MBTL1
SCHEMBL20005538 0.84 TDP1 (0.36) TDP1LMNAL3MBTL1
SCHEMBL13621719 0.83 TDP1 (0.32) TDP1
SCHEMBL12969862 0.77 LMNA (0.33) TDP1LMNAL3MBTL1
SCHEMBL14294311 0.77 TDP1 (0.38) TDP1LMNAL3MBTL1
SCHEMBL18089526 0.77 TDP1 (0.38) TDP1LMNAL3MBTL1
SCHEMBL20172545 0.77 TDP1 (0.38) TDP1LMNAL3MBTL1
SCHEMBL14155299 0.76 LMNA (0.32) TDP1LMNAL3MBTL1
SCHEMBL8766931 0.75 LMNA (0.44) TDP1LMNAL3MBTL1
SCHEMBL16383894 0.74 TRPV1 (0.33) TDP1LMNAL3MBTL1

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-20080112951-A1 Glycoconjugates and Their Use as Potential Vaccines Against Infection by Shigella Flexneri CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2008-05-15 US disclosed