SCHEMBL7589685

SCHEMBL7589685

CC(=O)OOC(C)(C)C.CC(C)(C)OOC(=O)c1ccccc1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.86
TSHR P16473 4/20 0.86
ALDH1A1 P00352 3/20 0.86
HSD17B10 Q99714 1/20 0.86
LMNA P02545 2/20 0.55
F2 P00734 1/20 0.55
MAPT P10636 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPK1 P28482 1/20 0.42
HIF1A Q16665 1/20 0.42
ELANE P08246 1/20 0.41
CYP2D6 P10635 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
TP53 P04637 1/20 0.39
SLC6A3 Q01959 2/20 0.39
HTR1A P08908 1/20 0.39
SCN1A P35498 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
Acetic Acid SCHEMBL28044564 0.93 TDP1 (0.92) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL22820 0.93 TSHR (1.00) TDP1TSHRALDH1A1HSD17B10LMNA
Hydrogen Peroxide SCHEMBL29071816 0.93 TSHR (1.00) TDP1TSHRALDH1A1HSD17B10LMNA
Benzene SCHEMBL9464161 0.93 TSHR (1.00) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL9183136 0.93 TSHR (1.00) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL9422161 0.92 TSHR (0.77) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL28268640 0.92 TDP1 (0.77) TDP1TSHRALDH1A1HSD17B10LMNA
Ethaneperoxoic Acid SCHEMBL20912979 0.91 TDP1 (0.83) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL28771784 0.91 TDP1 (0.96) TDP1TSHRALDH1A1HSD17B10LMNA
SCHEMBL11143628 0.91 TDP1 (0.96) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120158091-A Resin composition, metal foil-clad laminate and printed circuit board 广东生益科技股份有限公司 2025-06-17 CN disclosed
EP-3255088-B1 USE OF VULCANIZABLE COMPOSITIONS AND VULCANIZATES IN CONTACT WITH SILANE-COATED WOLLASTONITE CONTAINING COOLANT ARLANXEO DEUTSCHLAND GMBH (DE) 2020-04-29 EP disclosed
CN-109153875-A Aqueous coating composition for oxygen barrier coatings containing low conductivity polymer dispersions and layered silicates 巴斯夫欧洲公司 2019-01-04 CN disclosed
US-20020043643-A1 Modified polypropylene, process for preparing modified polypropylene, modified polyropylene composition and foamed product MITSUI CHEMICALS, INC. (JP) 2002-04-18 US disclosed