SCHEMBL2912166

SCHEMBL2912166

CC(=O)Oc1cc(C)c(O)c(C)c1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
HTT P42858 2/20 0.50
ACHE P22303 2/20 0.43
MAPT P10636 3/20 0.42
KDM4E B2RXH2 3/20 0.42
GAA P10253 3/20 0.42
HSD17B10 Q99714 2/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 2/20 0.41
CYP3A4 P08684 2/20 0.41
MEN1 O00255 1/20 0.41
GFER P55789 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 2/20 0.40
TNFSF11 O14788 1/20 0.40
GLA P06280 1/20 0.40
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 1/20 0.40

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
SCHEMBL11611151 0.86 CYP3A4 (0.42) POLBHTTMAPTKDM4EGAA
SCHEMBL11611146 0.84 CYP3A4 (0.44) POLBHTTMAPTKDM4EGAA
SCHEMBL27298985 0.83 POLB (0.44) POLBHTTACHEMAPTKDM4E
SCHEMBL15388582 0.83 POLB (0.41) POLBHTTACHEMAPTKDM4E
SCHEMBL2910532 0.82 POLB (0.62) POLBHTTACHEMAPTKDM4E
SCHEMBL2114307 0.81 POLB (0.53) POLBHTTACHEMAPTKDM4E
SCHEMBL28294695 0.81 CYP3A4 (0.42) POLBHTTMAPTKDM4EGAA
SCHEMBL4472816 0.81 POLB (0.45) POLBHTTACHEMAPTKDM4E
SCHEMBL15642113 0.80 POLB (0.65) POLBHTTACHEMAPTKDM4E
SCHEMBL5958117 0.79 ELANE (0.42) POLBMAPTHPGDCYP3A4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018108606-A1 PROCESS FOR THE MANUFACTURE OF 6,10-DIMETHYLUNDECAN-2-ONE, ISOPHYTOL, ALPHA-TOCOPHEROL (ACETATE) AND FURTHER INTERMEDIATES THEREOF DSM IP ASSETS B.V. (NL) 2018-06-21 WO claimed
EP-1239045-B1 Process for the manufacture of a vitamin E intermediate DSM IP ASSETS BV (NL) 2010-08-25 EP claimed
EP-1562929-B1 MANUFACTURE OF TOCOPHERYL ACETATE DSM IP ASSETS BV (NL) 2007-11-14 EP claimed
US-6790967-B2 PREPARING ALPHA-TOCOPHEROL BY THE CONDENSATION OF A PHYTOL WITH TRIMETHYLHYDROQUINONE IN A POLAR ESTER SOLVENT AND IN THE PRESENCE OF A BRONSTED ACID, A ZINC HALIDE AND WATER, THE WATER PREVENTING SIDE REACTIONS OF TMHQ AT THE BEGINNING ADISSEO FRANCE S.A.S. (FR) 2004-09-14 US claimed
US-6743615-B2 CONVERTING TRIMETHYLHYDROQUINONE DIACETATE (TMHQ-DA) INTO THE CORRESPONDING MONOACETATE (TMHQ-1-MA) WITH A LIPASE ROCHE VITAMINS, INC. 2004-06-01 US claimed
EP-1114041-B1 PROCESS FOR THE PREPARATION OF ALPHA-TOCOPHEROL ACETATE AVENTIS ANIMAL NUTRITION SA (FR) 2004-03-31 EP claimed
US-20020161246-A1 Process for the manufacture of a vitamin E intermediate DSM NUTRITIONAL PRODUCTS, INC. 2002-10-31 US claimed
EP-1239045-A1 Process for the manufacture of a vitamin E intermediate Roche Vitamins AG (CH) 2002-09-11 EP claimed
US-6441249-B2 ACID CATALYSIS OF ISOPHERONE, DISTILLATION, OXIDATION IN AMORPHOUS CARBON AND BASE FORMING 4-OXOISOPHORONE WHICH REACTS WITH ACID ANHYDRIDE/CARBOXYLIC ACID TO FORM COMPOUND HYDROLYZED TO TRIMETHYLHYDROQUINONE; EFFICIENCY; VITAMIN E NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 2002-08-27 US claimed
US-6320086-B1 REACTING ISOPHORONE OVER ACID CATALYST, DISTILLING FORMED BETA-ISOPHORONE, OXIDIZING IN PRESENCE OF AMORPHOUS CARBON AND BASE TO 4-OXOISOPHORONE, REACTING IN VAPOR PHASE WITH CARBOXYLIC ACID USING SOLID ACID CATALYST, HYDROLYZING ESTER NIPPON PETROCHEMICALS COMPANY LIMITED (JP) 2001-11-20 US claimed
US-20010039366-A1 Method for producing trimethylhydroquinone NIPPON PETROCHEMICALS COMPANY LIMITED 2001-11-08 US claimed
US-6211418-B1 DISTILLING ISOPHORONE WITH ACID CATALYST TO RECOVER BETA-ISOPHORONE, OXIDIZING IN PRESENCE OF AMORPHOUS CARBON AND BASE TO 4-OXOISOPHORONE, REACTING IN VAPOR PHASE WITH CARBOXYLIC ACID USING SOLID ACID CATALYST, HYDROLYZING NIPPON PETROCHEMICALS COMPANY LIMITED (JP) 2001-04-03 US claimed
JP-11255707-A None JP disclosed
JP-11049711-A None JP disclosed
JP-11049710-A None JP disclosed
WO-2018108606-A1 PROCESS FOR THE MANUFACTURE OF 6,10-DIMETHYLUNDECAN-2-ONE, ISOPHYTOL, ALPHA-TOCOPHEROL (ACETATE) AND FURTHER INTERMEDIATES THEREOF DSM IP ASSETS B.V. (NL) 2018-06-21 WO disclosed
JP-H11255707-A PRODUCTION OF TRIMETHYLHYDROQUINONES NIPPON PETROCHEM CO LTD 1999-09-21 JP disclosed
EP-0924208-A1 Process for the preparation fo alpha-Tocopherol esters Degussa Aktiengesellschaft (DE) 1999-06-23 EP disclosed
JP-H1149710-A PRODUCTION OF TRIMETHYLHYDROQUINONES NIPPON PETROCHEM CO LTD 1999-02-23 JP disclosed
JP-H1149711-A PRODUCTION OF TRIMETHYLHYDROQUINONE NIPPON PETROCHEM CO LTD 1999-02-23 JP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010039366-A1 Method for producing trimethylhydroquinone APEH, CYP46A1, MSMO1 POLB 1081/4885HTT 2203/4885ACHE 1188/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.