SCHEMBL13044167

SCHEMBL13044167

CCOC(=O)C[C@@]1(C)OC[C@@H]2OC[C@@H](O)C2O1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 1/20 0.49
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 3/20 0.34
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
MGAM O43451 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
LMNA P02545 1/20 0.31
TRPA1 O75762 1/20 0.30

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
SCHEMBL9604192 1.00 CTDSP1 (0.49) CTDSP1KMT2AL3MBTL1GAAALDH1A1
SCHEMBL9604158 1.00 CTDSP1 (0.49) CTDSP1KMT2AL3MBTL1GAAALDH1A1
SCHEMBL9604156 1.00 CTDSP1 (0.49) CTDSP1KMT2AL3MBTL1GAAALDH1A1
SCHEMBL9604154 1.00 CTDSP1 (0.49) CTDSP1KMT2AL3MBTL1GAAALDH1A1
SCHEMBL9604159 1.00 CTDSP1 (0.49) CTDSP1KMT2AL3MBTL1GAAALDH1A1
SCHEMBL9604129 0.89 CTDSP1 (0.40) CTDSP1ALDH1A1LMNA
SCHEMBL9604121 0.89 CTDSP1 (0.40) CTDSP1ALDH1A1LMNA
SCHEMBL9604148 0.89 CTDSP1 (0.40) CTDSP1ALDH1A1LMNA
SCHEMBL9604119 0.89 CTDSP1 (0.40) CTDSP1ALDH1A1LMNA
SCHEMBL9604186 0.89 CTDSP1 (0.40) CTDSP1ALDH1A1LMNA

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
WO-2010138842-A1 KETAL ESTERS OF ANHYDROPENTITOLS AND USES THEREOF XLTERRA, INC. (US) 2010-12-02 WO disclosed