SCHEMBL3007645

SCHEMBL3007645

CCCCCCCCCC(=O)OC(C)c1nccn1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.49
MAPK1 P28482 5/20 0.47
MAPT P10636 5/20 0.47
ALDH1A1 P00352 1/20 0.44
PRKCA P17252 1/20 0.42
PRKCE Q02156 1/20 0.42
PRKCQ Q04759 1/20 0.42
PRKCD Q05655 1/20 0.42
GMNN O75496 3/20 0.41
NPSR1 Q6W5P4 3/20 0.41
MEN1 O00255 2/20 0.41
HSP90AA1 P07900 2/20 0.41
BLM P54132 2/20 0.41
KMT2A Q03164 2/20 0.41
NR1H4 Q96RI1 2/20 0.41
GLA P06280 1/20 0.41
PMP22 Q01453 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP1A2 P05177 2/20 0.39
TP53 P04637 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
SCHEMBL3012042 0.80 L3MBTL1 (0.43) LMNAMAPK1MAPTALDH1A1MEN1
SCHEMBL25866454 0.77 MAPT (0.38) LMNAMAPK1MAPTALDH1A1PRKCA
SCHEMBL2998187 0.77 KMT2A (0.46) LMNAMAPK1MAPTALDH1A1MEN1
Hydrochloric Acid SCHEMBL31438859 0.70 TBXAS1 (0.41) LMNAMAPTKMT2AL3MBTL1
Hydrochloric Acid SCHEMBL31094676 0.70 TLR8 (0.41) ALDH1A1KMT2AL3MBTL1
SCHEMBL19087084 0.69 TLR8 (0.41) LMNAMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL17683986 0.69 LMNA (0.57) LMNAMAPK1MAPTALDH1A1PRKCA
SCHEMBL10766988 0.69 LMNA (0.57) LMNAMAPK1MAPTALDH1A1PRKCA
SCHEMBL8638934 0.69 LMNA (0.57) LMNAMAPK1MAPTALDH1A1PRKCA
SCHEMBL8642007 0.69 LMNA (0.57) LMNAMAPK1MAPTALDH1A1PRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362095-B2 Defoaming of ionic liquids EVONIK GOLDSCHMIDT GMBH (DE) 2013-01-29 US disclosed
US-20100192814-A1 PROCESS FOR PRODUCING ANTISTATICALLY TREATED ARTIFICIAL STONE FOR FLAT STRUCTURES EVONIK GOLDSCHMIDT GMBH (DE) 2010-08-05 US disclosed
US-20100084597-A1 DEFOAMING OF IONIC LIQUIDS EVONIK DEGUSSA GMBH (DE) 2010-04-08 US disclosed
US-20100029519-A1 PERFORMANCE ADDITIVES FOR IMPROVING THE WETTING PROPERTIES OF IONIC LIQUIDS ON SOLID SURFACES EVONIK DEGUSSA GMBH (DE) 2010-02-04 US disclosed