SCHEMBL13998564

SCHEMBL13998564

CC(CC(C)OC(CO)CO)OC(CO)CO

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.35
MAPK1 P28482 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
SCHEMBL14321178 0.89 TSHR (0.40) TSHRTDP1
SCHEMBL15426520 0.85 TSHR (0.39) TSHRTDP1MAPK1
SCHEMBL17945416 0.85 TSHR (0.39) TSHRTDP1MAPK1
SCHEMBL1830689 0.80 TSHR (0.35) TSHRTDP1MAPK1
SCHEMBL8528740 0.77 TSHR (0.37) TSHRTDP1
SCHEMBL1828241 0.76 TSHR (0.46) TSHRTDP1MAPK1
SCHEMBL17664807 0.75
SCHEMBL23819364 0.74 TDP1 (0.40) TSHRTDP1
SCHEMBL10344859 0.74 TSHR (0.35) TSHRTDP1
SCHEMBL24172654 0.74 RCE1 (0.40) TSHRMAPK1

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-2008147671-A2 GLYCEROL DERIVATIVES AND METHODS OF MAKING SAME GLOBAL AGRITECH INC (US) 2008-12-04 WO disclosed