SCHEMBL7718229

SCHEMBL7718229

CC(C)(OO)c1cccc(O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.59
ALOX15 P16050 1/20 0.59
CYP3A4 P08684 4/20 0.44
CA12 O43570 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
LMNA P02545 1/20 0.44
CA5A P35218 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
ESR1 P03372 3/20 0.44
ESR2 Q92731 3/20 0.44
TSHR P16473 2/20 0.41
ACHE P22303 2/20 0.41
HSD17B1 P14061 2/20 0.40
HSD17B2 P37059 2/20 0.40
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
KIF11 P52732 1/20 0.38

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
SCHEMBL29472192 1.00 ALDH1A1 (0.59) ALDH1A1ALOX15CYP3A4CA12CA2
SCHEMBL2969176 0.87 ALDH1A1 (0.70) ALDH1A1ALOX15CYP3A4ESR1ESR2
SCHEMBL2969906 0.79 ALDH1A1 (0.59) ALDH1A1ALOX15ESR1ESR2ACHE
SCHEMBL5550696 0.79 ALDH1A1 (0.59) ALDH1A1ALOX15CYP3A4LMNAACHE
SCHEMBL2957052 0.78 ESR1 (0.54) ALDH1A1CYP3A4CA12CA2CA9
SCHEMBL1492513 0.78 ESR1 (0.68) ALDH1A1CYP3A4CA12CA2CA9
SCHEMBL50933 0.78 HDAC4 (0.57) ALDH1A1ALOX15CYP3A4CA12CA2
SCHEMBL31284901 0.78 ESR1 (0.68) ALDH1A1CYP3A4CA12CA2CA9
SCHEMBL29427097 0.78 HDAC4 (0.57) ALDH1A1ALOX15CYP3A4CA12CA2
SCHEMBL29472201 0.78 ALDH1A1 (0.57) ALDH1A1ALOX15CYP3A4CA12CA2

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119241412-A Method for synthesizing 3- (2-hydroperoxy-2-propyl) phenol 中国石油化工股份有限公司 2025-01-03 CN claimed
EP-0327361-B1 3-(2-HYDROPEROXY-2-PROPYL)PHENOL AND METHOD OF PRODUCING RESORCINOL USING THE SAME MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-03-17 EP claimed
US-5068455-A Oxidation of 3-(2-hydroxy-2-propyl)phenol or m-isopropenylphenol to form hydroperoxide MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-11-26 US claimed
US-5030767-A Decomposition, solvent, inorganic acid or arenesulfonic acid as catalyst MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-07-09 US claimed
EP-0327361-A1 3-(2-hydroperoxy-2-propyl)phenol and method of producing resorcinol using the same MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-08-09 EP claimed
JP-1199926-A None JP disclosed
JP-1199926-A None JP disclosed
JP-2134363-A None JP disclosed
JP-2134363-A None JP disclosed
CN-119241412-A Method for synthesizing 3- (2-hydroperoxy-2-propyl) phenol 中国石油化工股份有限公司 2025-01-03 CN disclosed
CN-119241412-A Method for synthesizing 3- (2-hydroperoxy-2-propyl) phenol 中国石油化工股份有限公司 2025-01-03 CN disclosed
CN-119241412-A Method for synthesizing 3- (2-hydroperoxy-2-propyl) phenol 中国石油化工股份有限公司 2025-01-03 CN disclosed
US-5030767-A Decomposition, solvent, inorganic acid or arenesulfonic acid as catalyst MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-07-09 US disclosed
JP-H02134363-A PRODUCTION OF 3-(2-HYDROPEROXY-2-PROPYL)PHENOL MITSUI PETROCHEM IND LTD 1990-05-23 JP disclosed
JP-H02134363-A PRODUCTION OF 3-(2-HYDROPEROXY-2-PROPYL)PHENOL MITSUI PETROCHEM IND LTD 1990-05-23 JP disclosed
JP-H01199926-A 3-(2-HYDROPEROXY-2-PROPYL)PHENOL AND PREPARATION OF RESORCINOL FROM SAID COMPOUND MITSUI PETROCHEM IND LTD 1989-08-11 JP disclosed
JP-H01199926-A 3-(2-HYDROPEROXY-2-PROPYL)PHENOL AND PREPARATION OF RESORCINOL FROM SAID COMPOUND MITSUI PETROCHEM IND LTD 1989-08-11 JP disclosed
EP-0327361-A1 3-(2-hydroperoxy-2-propyl)phenol and method of producing resorcinol using the same MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-08-09 EP disclosed
EP-0327361-A1 3-(2-hydroperoxy-2-propyl)phenol and method of producing resorcinol using the same MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-08-09 EP disclosed
EP-0327361-A1 3-(2-hydroperoxy-2-propyl)phenol and method of producing resorcinol using the same MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-08-09 EP disclosed