SCHEMBL8002773

SCHEMBL8002773

CCCCCCCCCC(CCCCCCCC)OC(=O)c1c(Br)c(Br)c(Br)c(Br)c1C(=O)OC(CCCCCCCC)CCCCCCCCC

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.41
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
FAAH O00519 4/20 0.40
PNLIP P16233 2/20 0.39
MAPK10 P53779 1/20 0.39
PRKCA P17252 1/20 0.39
PRKCD Q05655 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
GLS2 Q9UI32 2/20 0.39
ALDH1A1 P00352 1/20 0.38
GPR84 Q9NQS5 3/20 0.38
FFAR1 O14842 1/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL8002772 0.94 ALDH1A1 (0.41) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL27922465 0.86 PRKCA (0.44) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL30900869 0.76 PRSS1 (0.52) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL6669011 0.76 PNLIP (0.55) PNLIPPRKCAPRKCDALDH1A1MAPT
SCHEMBL6903809 0.76 PNLIP (0.55) PNLIPPRKCAPRKCDALDH1A1MAPT
SCHEMBL5373199 0.75 PNLIP (0.54) PNLIPPRKCAPRKCDALDH1A1MAPT
SCHEMBL16227358 0.75 PNLIP (0.54) PNLIPPRKCAPRKCDALDH1A1MAPT
SCHEMBL7649131 0.74 GPR84 (0.48) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL7645314 0.74 GPR84 (0.48) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL7644829 0.74 GPR84 (0.48) ZDHHC7LCKPPARDZDHHC20ZDHHC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1012133-A4 NOVEL FLAME RETARDANT PLASTICIZERS GREAT LAKES CHEMICAL CORP (US) 2000-08-30 EP disclosed
EP-1012133-A2 NOVEL FLAME RETARDANT PLASTICIZERS GREAT LAKES CHEMICAL CORPORATION (US) 2000-06-28 EP disclosed
WO-1998057920-A2 NOVEL FLAME RETARDANT PLASTICIZERS GREAT LAKES CHEMICAL CORPORATION (US) 1998-12-23 WO disclosed