Hydrogen Peroxide

Hydrogen Peroxide

SCHEMBL9840257

CC(C)c1ccc2cc(C(C)C)ccc2c1.OO

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 1/20 0.60
PTGS1 P23219 3/20 0.50
EIF4A3 P38919 1/20 0.50
TRPA1 O75762 1/20 0.50
CACNA1C Q13936 1/20 0.50
HIF1A Q16665 2/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
ALOX12 P18054 1/20 0.48
HTT P42858 1/20 0.48
AKR1C3 P42330 7/20 0.47
AKR1C2 P52895 7/20 0.47
PTGS2 P35354 3/20 0.47
CYP1A2 P05177 2/20 0.47
TSHR P16473 2/20 0.47
CDC42 P60953 1/20 0.47
RAC1 P63000 1/20 0.47
SLC22A6 Q4U2R8 1/20 0.47
LMNA P02545 1/20 0.46
MEN1 O00255 2/20 0.46

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
Hydrogen Peroxide SCHEMBL9172508 1.00 UGT2B7 (0.60) UGT2B7PTGS1EIF4A3TRPA1CACNA1C
SCHEMBL181347 0.94 UGT2B7 (0.58) UGT2B7PTGS1EIF4A3TRPA1CACNA1C
SCHEMBL30031337 0.94 UGT2B7 (0.58) UGT2B7PTGS1EIF4A3TRPA1CACNA1C
Hydrogen Peroxide SCHEMBL8096014 0.93 UGT2B7 (0.72) UGT2B7HIF1ACYP1A2TSHRMEN1
Water SCHEMBL10391367 0.92 UGT2B7 (0.56) UGT2B7PTGS1EIF4A3TRPA1CACNA1C
Water SCHEMBL9862270 0.92 UGT2B7 (0.56) UGT2B7PTGS1EIF4A3TRPA1CACNA1C
Water SCHEMBL9862280 0.92 UGT2B7 (0.56) UGT2B7PTGS1EIF4A3TRPA1CACNA1C
Acetic Acid SCHEMBL28429217 0.91 EIF4A3 (0.53) UGT2B7PTGS1EIF4A3AKR1C3AKR1C2
SCHEMBL10749888 0.90 UGT2B7 (0.56) UGT2B7PTGS1EIF4A3TRPA1CACNA1C
SCHEMBL15003307 0.89 UGT2B7 (0.54) UGT2B7PTGS1EIF4A3TRPA1CACNA1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4503262-A Process for the production of 2,6-diisopropylnaphthalene dihydroperoxide VIRGINIA CHEMICALS, INC. (US) 1985-03-05 US claimed
JP-62070334-A None JP disclosed
EP-0239643-B1 PROCESS FOR OXIDIZING 2,6-DIISOPROPYLNAPHTHALENE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-08-21 EP disclosed
US-4996372-A In a basic aqueous solution, then acid cleaving in the presence of hydrogen peroxide MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-02-26 US disclosed
US-4929771-A Process for the preparation of alkyl-substituted phenols or naphthols CIBA-GEIGY CORPORATION (US) 1990-05-29 US disclosed
US-4861920-A Process for the preparation of 2,6-dihydroxynaphthalene CIBA-GEIGY CORPORATION (US) 1989-08-29 US disclosed
US-4814521-A Process for producing 2,6-dihydroxynaphthalene and 2,6-diacetoxynaphthalene KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-03-21 US disclosed
EP-0239643-A1 PROCESS FOR OXIDIZING 2,6-DIISOPROPYLNAPHTHALENE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1987-10-07 EP disclosed
JP-S6270334-A PRODUCTION OF 2,6-DIHYDROXYNAPHTHALENE MITSUI PETROCHEM IND LTD 1987-03-31 JP disclosed
US-4503262-A Process for the production of 2,6-diisopropylnaphthalene dihydroperoxide VIRGINIA CHEMICALS, INC. (US) 1985-03-05 US disclosed