SCHEMBL9941618

SCHEMBL9941618

CCCCCC/C=C/OC(=O)CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
F7 P08709 4/20 0.49
F3 P13726 4/20 0.49
KDM4E B2RXH2 3/20 0.49
PPARG P37231 3/20 0.49
PPARD Q03181 3/20 0.49
PPARA Q07869 3/20 0.49
FABP4 P15090 3/20 0.49
HSD17B10 Q99714 3/20 0.49
DUSP3 P51452 2/20 0.49
LMNA P02545 2/20 0.49
CYP19A1 P11511 2/20 0.49
ALOX15 P16050 2/20 0.49
PTGS1 P23219 2/20 0.49
NR4A2 P43354 2/20 0.49
SIRT6 Q8N6T7 2/20 0.49
PTPN7 P35236 1/20 0.49
FFAR1 O14842 1/20 0.49
FABP3 P05413 1/20 0.49
CYP3A4 P08684 1/20 0.49

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
SCHEMBL29519269 1.00 ALDH1A1 (0.49) ALDH1A1F7F3KDM4EPPARG
SCHEMBL8379633 1.00 ALDH1A1 (0.49) ALDH1A1F7F3KDM4EPPARG
SCHEMBL8018418 1.00 ALDH1A1 (0.49) ALDH1A1F7F3KDM4EPPARG
SCHEMBL4962158 0.98 PPARG (0.47) ALDH1A1F7F3KDM4EPPARG
SCHEMBL6936120 0.92 F7 (0.42) ALDH1A1F7F3KDM4EPPARG
SCHEMBL28588568 0.92 F7 (0.42) ALDH1A1F7F3KDM4EPPARG
SCHEMBL6936123 0.92 F7 (0.42) ALDH1A1F7F3KDM4EPPARG
SCHEMBL3883983 0.89 PPARG (0.53) ALDH1A1F7F3KDM4EPPARG
SCHEMBL4638672 0.89 PPARG (0.53) ALDH1A1F7F3KDM4EPPARG
SCHEMBL593337 0.89 PPARG (0.53) ALDH1A1F7F3KDM4EPPARG

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
US-20230397594-A1 USE OF DISPENSING DEVICES IN AGRICULTURAL APPLICATIONS BASF SE (DE) 2023-12-14 US disclosed
EP-2651883-B1 PROCESS FOR PREPARING AN ORGANIC SOLUTION OF A DIALKYL PEROXYDICARBONATE SOLVAY (BE) 2015-02-25 EP disclosed
EP-2651883-A1 PROCESS FOR PREPARING AN ORGANIC SOLUTION OF A DIALKYL PEROXYDICARBONATE SOLVAY SA (BE) 2013-10-23 EP disclosed
WO-2012080124-A1 PROCESS FOR PREPARING AN ORGANIC SOLUTION OF A DIALKYL PEROXYDICARBONATE SOLVAY SA (BE) 2012-06-21 WO disclosed
EP-0296550-A2 Phosphonium salts and processes for production of and uses for the same KURARAY CO., LTD. (JP) 1988-12-28 EP disclosed