SCHEMBL5016268

SCHEMBL5016268

CC(C)OC(=O)CCSCCC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
KMT2A Q03164 1/20 0.56
HSD17B10 Q99714 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
TSHR P16473 4/20 0.41
BHMT Q93088 4/20 0.39
MAPT P10636 2/20 0.37
PLA2G4B P0C869 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KDM6B O15054 1/20 0.36
KDM5C P41229 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
PHF8 Q9UPP1 1/20 0.36
KDM2A Q9Y2K7 1/20 0.36
CYP2C19 P33261 1/20 0.36
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRG2 P18507 2/20 0.34

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
SCHEMBL5016267 0.92 LMNA (0.52) LMNAKMT2AHSD17B10TDP1TSHR
Dodecanoate SCHEMBL31154194 0.85 LMNA (0.67) LMNAKMT2AHSD17B10TDP1TSHR
SCHEMBL5016284 0.83 LMNA (0.50) LMNAKMT2AHSD17B10TDP1TSHR
SCHEMBL283645 0.83 LMNA (0.52) LMNATSHRMAPTALDH1A1
SCHEMBL15948651 0.82 LMNA (0.52) LMNAKMT2AHSD17B10TDP1TSHR
SCHEMBL191308 0.81 LMNA (0.54) LMNATSHRMAPTKDM6BKDM5C
Hydrochloric Acid SCHEMBL11872252 0.79 LMNA (0.52) LMNATSHRMAPTKDM6BKDM5C
SCHEMBL5014587 0.77 TDP1 (0.52) LMNAKMT2AHSD17B10TDP1TSHR
SCHEMBL579015 0.77 HSD17B10 (0.64) LMNAKMT2AHSD17B10TDP1TSHR
SCHEMBL58343 0.77 LMNA (0.67) LMNAKMT2AHSD17B10TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1947725-A2 Polymer electrolyte composition and fuel cell Sumitomo Chemical Company, Limited (JP) 2008-07-23 EP disclosed
EP-1289041-B1 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL CO (JP) 2008-03-12 EP disclosed
US-20060257706-A1 POLYMER ELECTROLYTE COMPOSITION AND FUEL CELL HIDAKA YASUAKI 2006-11-16 US disclosed
US-20030113605-A1 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-06-19 US disclosed
EP-1289041-A2 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-05 EP disclosed