Tert-Butylbenzene

Tert-Butylbenzene

SCHEMBL28557232

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

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.64
TDP1 Q9NUW8 2/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
TNF P01375 1/20 0.55
KLF5 Q13887 1/20 0.55
NOD1 Q9Y239 1/20 0.55
ALDH1A1 P00352 3/20 0.52
TSHR P16473 2/20 0.52
HSD17B10 Q99714 1/20 0.52
ESRRG P62508 2/20 0.51
NPSR1 Q6W5P4 2/20 0.49
LMNA P02545 3/20 0.48
F2 P00734 1/20 0.48
KCNK9 Q9NPC2 1/20 0.46
CES1 P23141 1/20 0.46
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.44
HIF1A Q16665 1/20 0.44
SRD5A2 P31213 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL29035792 0.91 TDP1 (0.54) MAPTTDP1L3MBTL1TNFKLF5
SCHEMBL669305 0.86 HDAC1 (0.55) MAPTTDP1L3MBTL1TNFKLF5
Tert-Butanol SCHEMBL28695545 0.86 TDP1 (0.57) MAPTTDP1L3MBTL1TNFKLF5
Chloromethane SCHEMBL27484052 0.86 TSHR (0.60) MAPTTDP1L3MBTL1ALDH1A1TSHR
SCHEMBL11072811 0.85 MAPK1 (0.61) MAPTTDP1L3MBTL1TNFKLF5
SCHEMBL28282059 0.84 TDP1 (0.55) MAPTTDP1L3MBTL1TNFKLF5
SCHEMBL8659352 0.84 TNF (0.54) MAPTTDP1L3MBTL1TNFKLF5
Tert-Butyl Hydroperoxide SCHEMBL4202826 0.84 TDP1 (0.60) MAPTTDP1L3MBTL1TNFKLF5
Magnesium SCHEMBL31419301 0.84 HDAC1 (0.53) MAPTTDP1L3MBTL1TNFKLF5
Ethane SCHEMBL455951 0.83 TSHR (0.62) MAPTTDP1L3MBTL1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109320871-B Electromagnetic shielding wood-plastic composite material and preparation method thereof 山东宜居新材料科技有限公司 2021-04-20 CN claimed
CN-109320871-B Electromagnetic shielding wood-plastic composite material and preparation method thereof 山东宜居新材料科技有限公司 2021-04-20 CN disclosed