SCHEMBL5158787

SCHEMBL5158787

CC(C)(O)C(C)(C)OC(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.53
TSHR P16473 4/20 0.53
ALDH1A1 P00352 2/20 0.53
HSD17B10 Q99714 1/20 0.53
LMNA P02545 2/20 0.50
CYP2D6 P10635 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
F2 P00734 1/20 0.50
MAPT P10636 3/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TP53 P04637 1/20 0.47
MAPK1 P28482 1/20 0.46
HIF1A Q16665 1/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 1/20 0.44
SRC P12931 1/20 0.43
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
SLC6A3 Q01959 2/20 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
SCHEMBL1786261 0.90 TSHR (0.59) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL8945819 0.83 TSHR (0.57) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL27622624 0.82 TDP1 (0.52) TDP1TSHRALDH1A1HSD17B10LMNA
Acetophenone SCHEMBL11149993 0.82 TSHR (0.52) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL18131450 0.82 TSHR (0.52) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL1953844 0.81 TSHR (0.59) TDP1TSHRALDH1A1HSD17B10LMNA
Hydrogen Peroxide SCHEMBL28474133 0.81 TDP1 (0.64) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL260960 0.81 TDP1 (0.64) TDP1TSHRALDH1A1HSD17B10LMNA
Hydrogen Peroxide SCHEMBL28425777 0.81 TDP1 (0.64) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL29199324 0.81 TDP1 (0.64) TDP1TSHRALDH1A1HSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100578769-C Organic matrix containing nanomaterials to enhance bulk thermal conductivity GEN ELECTRIC 2010-01-06 CN disclosed
CN-1989614-A Organic matrices containing nano materials to enhance bulk thermal conductivity GEN ELECTRIC (US) 2007-06-27 CN disclosed
EP-1751796-A1 ORGANIC MATRICES CONTAINING NANOMATERIALS TO ENHANCE BULK THERMAL CONDUCTIVITY General Electric Company, (a New York Corporation) (US) 2007-02-14 EP disclosed
US-7013965-B2 Organic matrices containing nanomaterials to enhance bulk thermal conductivity GENERAL ELECTRIC COMPANY (US) 2006-03-21 US disclosed
WO-2005119771-A1 ORGANIC MATRICES CONTAINING NANOMATERIALS TO ENHANCE BULK THERMAL CONDUCTIVITY GENERAL ELECTRIC COMPANY (US) 2005-12-15 WO disclosed
US-20050161210-A1 ORGANIC MATRICES CONTAINING NANOMATERIALS TO ENHANCE BULK THERMAL CONDUCTIVITY MOMENTIVE PERFORMANCE MATERIALS INC. 2005-07-28 US disclosed