SCHEMBL1556513

SCHEMBL1556513

CCCCOOC(=O)OCC(CC)CCCC

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.57
TSHR P16473 3/20 0.57
TDP1 Q9NUW8 2/20 0.57
ATM Q13315 2/20 0.57
ALDH1A1 P00352 6/20 0.50
CA2 P00918 4/20 0.50
RECQL P46063 1/20 0.48
LMNA P02545 3/20 0.46
MAPK1 P28482 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP14 P50281 1/20 0.43
CA1 P00915 1/20 0.39

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
SCHEMBL3878323 0.95 CYP3A4 (0.55) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL3478363 0.91 CYP3A4 (0.54) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL584511 0.90 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL35431 0.88 CYP3A4 (0.66) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL3663925 0.87 CYP3A4 (0.53) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL669520 0.86 CYP3A4 (0.53) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL2685759 0.85 CYP3A4 (0.51) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL93541 0.85 CYP3A4 (0.62) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL12669245 0.84 CYP3A4 (0.54) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL94797 0.84 CYP3A4 (0.70) CYP3A4TSHRTDP1ATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1799728-A1 CURABLE FORMULATIONS, CURED COMPOSITIONS, AND ARTICLES DERIVED THEREFROM General Electric Company (US) 2007-06-27 EP claimed
WO-2006036489-A1 CURABLE FORMULATIONS, CURED COMPOSITIONS, AND ARTICLES DERIVED THEREFORM GENERAL ELECTRIC COMPANY (US) 2006-04-06 WO claimed
EP-3746490-A1 PHOTOLABILE BETA-DICARBONYL COMPOUNDS 3M Innovative Properties Company (US) 2020-12-09 EP disclosed
WO-2020132929-A1 PHOSPHOROUS AND SILICON CONTAINING FLAME RETARDANT, PREPARATION METHOD THEREFOR, FLAME RETARDANT RESIN COMPOSITION, PREPREG AND METAL FOIL-CLADDING LAMINATE 广东生益科技股份有限公司 2020-07-02 WO disclosed
WO-2019152267-A1 PHOTOLABILE BETA-DICARBONYL COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-08-08 WO disclosed
EP-3030608-A2 METHOD FOR PREPARING BLACK EXPANDABLE POLYSTYRENE Arkema France (FR) 2016-06-15 EP disclosed
WO-2015019008-A2 METHOD FOR PREPARING BLACK EXPANDABLE POLYSTYRENE ARKEMA FRANCE (FR) 2015-02-12 WO disclosed
WO-2014110229-A1 ELECTRICALLY CONDUCTIVE ADHESIVES COMPRISING BLEND ELASTOMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2014-07-17 WO disclosed
EP-2579907-A2 ARTICLES HAVING NON-FOULING SURFACES AND PROCESSES FOR PREPARING THE SAME INCLUDING APPLYING A PRIMER COAT Semprus Biosciences Corporation (US) 2013-04-17 EP disclosed
EP-2303959-A2 MIXTURE OF PEROXIDES FOR CROSSLINKING ELASTOMERS Arkema France (FR) 2011-04-06 EP disclosed
WO-2010007315-A3 MIXTURE OF PEROXIDES FOR CROSSLINKING ELASTOMERS ARKEMA FRANCE (FR) 2010-03-11 WO disclosed
WO-2010007315-A2 MIXTURE OF PEROXIDES FOR CROSSLINKING ELASTOMERS ARKEMA FRANCE (FR) 2010-01-21 WO disclosed