SCHEMBL5989964

SCHEMBL5989964

C=Cc1cc(OC)ccc1OCCCCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.47
CYSLTR1 Q9Y271 1/20 0.47
CYP1A1 P04798 2/20 0.44
CYP1B1 Q16678 2/20 0.44
CYP1A2 P05177 1/20 0.44
NFE2L2 Q16236 1/20 0.44
AHR P35869 1/20 0.43
SMPD1 P17405 3/20 0.43
NR5A1 Q13285 1/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PLA2G4B P0C869 1/20 0.41
CNR2 P34972 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
JUN P05412 1/20 0.41

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
SCHEMBL3696707 1.00 CYSLTR2 (0.47) CYSLTR2CYSLTR1CYP1A1CYP1B1CYP1A2
SCHEMBL8508183 1.00 CYSLTR2 (0.47) CYSLTR2CYSLTR1CYP1A1CYP1B1CYP1A2
SCHEMBL55512 0.91 NR5A1 (0.49) NR5A1PLA2G4BCNR2TSHR
SCHEMBL5988917 0.91 NR5A1 (0.49) NR5A1PLA2G4BCNR2TSHR
SCHEMBL5146667 0.91 NR5A1 (0.49) NR5A1PLA2G4BCNR2TSHR
SCHEMBL3236127 0.91 NR5A1 (0.49) NR5A1PLA2G4BCNR2TSHR
SCHEMBL5144856 0.91 NR5A1 (0.49) NR5A1PLA2G4BCNR2TSHR
SCHEMBL9786748 0.91 NR5A1 (0.49) NR5A1PLA2G4BCNR2TSHR
SCHEMBL9539369 0.85 PTGES (0.46) CYP1A2AHRNR5A1ALDH1A1MAPT
SCHEMBL9559883 0.85 KDM4E (0.54) CYSLTR2CYSLTR1CYP1A1CYP1B1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7018724-B2 Organic EL device and preparation method TDK CORPORAITON (JP) 2006-03-28 US disclosed
US-20050064241-A1 Organic EL device and preparation method TDK CORPORATION (JP) 2005-03-24 US disclosed
US-6821649-B2 ELECTRON INJECTING ORGANIC LAYER CONTAINING AN ORGANIC SALT OR COMPLEX OF A METAL; LAYER CONTAINING A HIGH MOLECULAR WEIGHT EL MATERIAL IS DISPOSED CLOSE TO THE ELECTRON INJECTING ORGANIC LAYER. TDK CORPORATION (JP) 2004-11-23 US disclosed
US-20030044645-A1 Organic EL device and preparation method TDK CORPORATION (JP) 2003-03-06 US disclosed
EP-1285957-A2 Organic electroluminescent device and method of its preparation TDK Corporation (JP) 2003-02-26 EP disclosed
EP-0757088-B1 Organoelectroluminescence device material and organoelectroluminescence device for which the material is adapted TOYO INK MFG CO (JP) 2000-06-07 EP disclosed
US-6001284-A Organoelectroluminescence device material and organoelectroluminescence device for which the material is adapted TOYO INK MANUFACTURING CO., LTD. (JP) 1999-12-14 US disclosed
EP-0757088-A2 Organoelectroluminescence device material and organoelectroluminescence device for which the material is adapted TOYO INK MANUFACTURING CO., LTD. (JP) 1997-02-05 EP disclosed