Tert-Butyl Hydroperoxide

Tert-Butyl Hydroperoxide

SCHEMBL28009452

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

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
PGD P52209 1/20 0.33
BHMT Q93088 1/20 0.33
CYP1A2 P05177 1/20 0.31
SLC22A6 Q4U2R8 1/20 0.31
CACNA2D1 P54289 2/20 0.31
CACNB3 P54284 1/20 0.31
CACNA1C Q13936 1/20 0.31
PGR P06401 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR2B P41595 1/20 0.31
CACNA2D2 Q9NY47 1/20 0.31
MAPT P10636 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30

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
SCHEMBL143938 0.89 SLC22A6 (0.38) ALDH1A1BHMTCYP1A2SLC22A6CACNA2D1
SCHEMBL1832855 0.88 PGD (0.33) ALDH1A1PGDBHMTCYP1A2SLC22A6
SCHEMBL21315733 0.87 BHMT (0.36) ALDH1A1BHMTCYP1A2SLC22A6CACNA2D1
Hydrochloric Acid SCHEMBL7940858 0.87 BHMT (0.36) ALDH1A1BHMTCYP1A2SLC22A6CACNA2D1
SCHEMBL17584789 0.87 BHMT (0.36) ALDH1A1BHMTCYP1A2SLC22A6CACNA2D1
SCHEMBL4269719 0.87 BHMT (0.36) ALDH1A1BHMTCYP1A2SLC22A6CACNA2D1
SCHEMBL4658903 0.87 BHMT (0.36) ALDH1A1BHMTCYP1A2SLC22A6CACNA2D1
SCHEMBL22396502 0.87 BHMT (0.36) ALDH1A1BHMTCYP1A2SLC22A6CACNA2D1
Ammonia Solution, Strong SCHEMBL22134457 0.87 TDP1 (0.40) ALDH1A1BHMTCYP1A2SLC22A6CACNA2D1
SCHEMBL11801707 0.87 BHMT (0.36) ALDH1A1BHMTCYP1A2SLC22A6CACNA2D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108699343-A Curable composition for producing resin sheet providing tough cured product 东亚合成株式会社 2018-10-23 CN disclosed
CN-108102195-A A kind of cable insulation material and preparation method containing self-repairing microcapsule 成都新柯力化工科技有限公司 2018-06-01 CN disclosed
CN-103270058-B Vinylidene fluoride copolymer 索尔维特殊聚合物意大利有限公司 2017-12-05 CN disclosed
CN-107207643-A Resin sheet manufacture curing composition 东亚合成株式会社 2017-09-26 CN disclosed
CN-104736580-B Aqueous dispersion Pioloform, polyvinyl acetal particulate 积水化学工业株式会社 2017-08-01 CN disclosed
CN-106413665-A Bonding method, bonding kit, and bonding material 德山齿科株式会社 2017-02-15 CN disclosed
CN-104487620-A Expanding material in nonwoven 3-d structure SIKA TECHNOLOGY AG 2015-04-01 CN disclosed