SCHEMBL7150795

SCHEMBL7150795

CO[C@@H]1C=CO[C@H](COC(C)=O)[C@H]1OC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.46
CYP2D6 P10635 2/20 0.46
THRB P10828 1/20 0.46
TSHR P16473 2/20 0.45
MAPT P10636 4/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
ALDH1A1 P00352 1/20 0.42
NR3C1 P04150 1/20 0.42
FYN P06241 1/20 0.42
ADRA2A P08913 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
ADRA2B P18089 1/20 0.42
DRD4 P21917 1/20 0.42
DRD3 P35462 1/20 0.42
CA12 O43570 7/20 0.41
CA1 P00915 7/20 0.41
CA2 P00918 7/20 0.41
CA9 Q16790 7/20 0.41
PTPN1 P18031 1/20 0.40

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
SCHEMBL25985483 0.92 HSD17B10 (0.47) HSD17B10CYP2D6THRBTSHRMAPT
SCHEMBL13402445 0.92 HSD17B10 (0.47) HSD17B10CYP2D6THRBTSHRMAPT
SCHEMBL8602259 0.92 HSD17B10 (0.47) HSD17B10CYP2D6THRBTSHRMAPT
SCHEMBL10148737 0.92 HSD17B10 (0.47) HSD17B10CYP2D6THRBTSHRMAPT
SCHEMBL62522 0.92 HSD17B10 (0.47) HSD17B10CYP2D6THRBTSHRMAPT
SCHEMBL12968777 0.92 HSD17B10 (0.47) HSD17B10CYP2D6THRBTSHRMAPT
SCHEMBL78636 0.92 HSD17B10 (0.47) HSD17B10CYP2D6THRBTSHRMAPT
SCHEMBL13427968 0.92 HSD17B10 (0.47) HSD17B10CYP2D6THRBTSHRMAPT
SCHEMBL15494654 0.92 HSD17B10 (0.47) HSD17B10CYP2D6THRBTSHRMAPT
SCHEMBL12083311 0.92 HSD17B10 (0.47) HSD17B10CYP2D6THRBTSHRMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6562514-B1 Stabilized vanadium electrolyte solutions for all-vanadium redox cells and batteries PINNACLE VRB LIMITED (AU) 2003-05-13 US disclosed
US-6468688-B2 CHARGING, DISCHARGING EFFICIENCY; VANADIUM ELECTROLYTE PINNACLE VRB LIMITED (AU) 2002-10-22 US disclosed
US-20010028977-A1 Charging, discharging efficiency; vanadium electrolyte JD HOLDING INC. (KY) 2001-10-11 US disclosed
US-6143443-A ALL-VANADIUM REDOX BATTERY, COMPRISING THE STABILIZED ELECTROLYTE PINNACLE ARB LIMITED (AU) 2000-11-07 US disclosed