SCHEMBL25868836

SCHEMBL25868836

CC(O)COC(C)C(O)O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.43
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.40
TSHR P16473 2/20 0.35
LMNA P02545 1/20 0.34
ALDH1A1 P00352 1/20 0.33
MAPT P10636 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
SCHEMBL737249 0.82 TDP1 (0.43) TDP1MAPK1HSD17B10TSHRLMNA
SCHEMBL15119453 0.80 TDP1 (0.41) TDP1MAPK1HSD17B10TSHRLMNA
SCHEMBL3791828 0.78 TDP1 (0.40) TDP1MAPK1HSD17B10TSHRLMNA
SCHEMBL9052623 0.78 TDP1 (0.40) TDP1MAPK1HSD17B10TSHRLMNA
SCHEMBL2220557 0.78 TDP1 (0.45) TDP1MAPK1HSD17B10TSHRLMNA
SCHEMBL1220066 0.78 TDP1 (0.40) TDP1MAPK1HSD17B10TSHRLMNA
SCHEMBL1959442 0.76 TDP1 (0.43) TDP1MAPK1HSD17B10TSHRLMNA
Propylene Glycol SCHEMBL5833472 0.76 TDP1 (0.50) TDP1MAPK1HSD17B10TSHRLMNA
SCHEMBL19263925 0.76 TDP1 (0.43) TDP1MAPK1HSD17B10TSHRLMNA
SCHEMBL2945715 0.76 TDP1 (0.39) TDP1MAPK1HSD17B10TSHRLMNA

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-2023135229-A1 GLYCOSIDE HYDROLASE AND/OR TRANSGLYCOSYLASE FOR SYNTHESIS OF XYLOSE OLIGOSACCHARIDES MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2023-07-20 WO disclosed