SCHEMBL3159735

SCHEMBL3159735

CC(O)COC(C)(C)C.COCCOC

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.77
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL1040994 0.88
SCHEMBL2087163 0.88
SCHEMBL35599 0.88
Propane SCHEMBL28856185 0.83 MAPK1 (0.90) MAPK1HSD17B10TDP1
Tert-Butanol SCHEMBL5520538 0.83 MAPK1 (0.90) MAPK1HSD17B10TDP1
Propylene Glycol SCHEMBL28059743 0.81 MAPK1 (0.85) MAPK1HSD17B10TDP1
SCHEMBL17107819 0.80 HSD17B10 (0.48) MAPK1HSD17B10TDP1
Acetic Acid SCHEMBL3250234 0.79 MAPK1 (0.81) MAPK1HSD17B10TDP1
SCHEMBL13492157 0.77 MAPK1 (0.45) MAPK1HSD17B10
Terbuprol SCHEMBL1815375 0.76 MAPK1 (0.54) MAPK1TDP1

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-7645717-B2 Nano-scale DMC catalyst particles DOW GLOBAL TECHNOLOGIES, INC. (US) 2010-01-12 US disclosed
US-20070191216-A1 Nano-scale dmc catalyst particles DOW GLOBAL TECHNOLOGIES LLC 2007-08-16 US disclosed
EP-1628766-B1 NANO-SCALE DMC CATALYST PARTICLES DOW GLOBAL TECHNOLOGIES INC (US) 2007-01-24 EP disclosed
EP-1628766-A1 NANO-SCALE DMC CATALYST PARTICLES Dow Global Technologies Inc. (US) 2006-03-01 EP disclosed
WO-2004105944-A1 NANO-SCALE DMC CATALYST PARTICLES DOW GLOBAL TECHNOLOGIES INC. (US) 2004-12-09 WO disclosed