SCHEMBL2349684

SCHEMBL2349684

CCOC(=O)OC1=C(C)C=CCC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
SOAT1 P35610 1/20 0.35
KMT2A Q03164 4/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
CUL4A Q13619 3/20 0.32
TYMS P04818 1/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
ALOX15 P16050 1/20 0.32
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
MMP14 P50281 1/20 0.32

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
SCHEMBL754466 0.75 MAPT (0.39) ALDH1A1KMT2AMAOAL3MBTL1ALOX15
SCHEMBL12593707 0.70 CA12 (0.43) MAOAMAOB
SCHEMBL30050431 0.67 POLB (0.39) SOAT1KMT2AGSK3AGSK3BL3MBTL1
SCHEMBL25208706 0.67 MAPK1 (0.38) ALDH1A1KMT2AL3MBTL1ALOX15MEN1
SCHEMBL11528099 0.67 MAPT (0.37) ALDH1A1KMT2AMAOAALOX15POLB
SCHEMBL11455467 0.66 MAOA (0.33) MAOAMAOB
SCHEMBL13966472 0.66 PTGS1 (0.33) ALDH1A1MAOAMAOBL3MBTL1ALOX15
SCHEMBL3986394 0.66 MAOA (0.33) MAOAMAOB
SCHEMBL4366145 0.65 MAOA (0.36) MAOAMAOBL3MBTL1
SCHEMBL25200829 0.65 MAPT (0.38) ALDH1A1KMT2AMAOAL3MBTL1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1737937-B1 PERFUME COMPOSITIONS GIVAUDAN NEDERLAND SERVICES BV (NL) 2013-06-12 EP claimed
WO-2011101181-A1 PERFUME COMPOSITIONS HENKEL AG & CO. KGAA (DE) 2011-08-25 WO claimed
EP-3914685-A1 MULTI-COMPONENT CLEANING SYSTEM Henkel AG & Co. KGaA (DE) 2021-12-01 EP disclosed
WO-2020152004-A1 MULTI-COMPONENT CLEANING SYSTEM HENKEL AG & CO. KGAA (DE) 2020-07-30 WO disclosed
EP-2566943-B1 PROCESS FOR RELEASING PREPARATIONS COMPRISING BLEACH DURING A WASHING PROGRAM OF A WASHING MACHINE BY MEANS OF A DOSING SYSTEM HENKEL AG & CO KGAA (DE) 2017-09-06 EP disclosed
EP-1948773-B1 FRAGRANT CONSUMER PRODUCTS COMPRISING OXIDIZING AGENTS HENKEL AG & CO KGAA (DE) 2016-03-30 EP disclosed
EP-2566943-A1 DOSING SYSTEM FOR RELEASING PREPARATIONS COMPRISING BLEACH DURING A WASHING PROGRAM OF A WASHING MACHINE Henkel AG & Co. KGaA (DE) 2013-03-13 EP disclosed
WO-2012126536-A1 DOSING SYSTEM FOR A DISHWASHER MACHINE HENKEL AG & CO. KGAA (DE) 2012-09-27 WO disclosed
WO-2011138218-A1 DOSING SYSTEM FOR RELEASING PREPARATIONS COMPRISING BLEACH DURING A WASHING PROGRAM OF A WASHING MACHINE HENKEL AG & CO. KGAA (DE) 2011-11-10 WO disclosed
WO-2011131256-A1 METERING SYSTEM FOR A WATER-CONDUCTING HOUSEHOLD APPLIANCE HENKEL AG & CO. KGAA (DE) 2011-10-27 WO disclosed
WO-2011101181-A1 PERFUME COMPOSITIONS HENKEL AG & CO. KGAA (DE) 2011-08-25 WO disclosed