SCHEMBL2910532

SCHEMBL2910532

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

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.62
▸ HTT P42858 2/20 0.61
▸ KDM4E B2RXH2 6/20 0.47
▸ GAA P10253 5/20 0.47
▸ HSD17B10 Q99714 4/20 0.47
▸ MAPT P10636 4/20 0.47
▸ TP53 P04637 1/20 0.47
▸ ACHE P22303 2/20 0.44
▸ TOP1 P11387 3/20 0.42
▸ ALDH1A1 P00352 5/20 0.42
▸ HPGD P15428 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ TNFSF11 O14788 1/20 0.41
▸ GLA P06280 2/20 0.41
▸ CASP1 P29466 2/20 0.41
▸ CASP7 P55210 2/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ HSP90AB1 P08238 1/20 0.41
▸ ALPG P10696 1/20 0.41
▸ ALOX15 P16050 1/20 0.41

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
SCHEMBL14407309 0.90 HTT (0.59) POLBHTTKDM4EGAAHSD17B10
SCHEMBL15642113 0.90 POLB (0.65) POLBHTTKDM4EGAAHSD17B10
SCHEMBL13954030 0.88 POLB (0.54) POLBHTTKDM4EGAAHSD17B10
SCHEMBL16666424 0.88 POLB (0.58) POLBHTTKDM4EGAAHSD17B10
SCHEMBL14458328 0.86 POLB (0.56) POLBHTTKDM4EGAAHSD17B10
SCHEMBL10941837 0.85 KDM4E (0.49) POLBHTTKDM4EGAAHSD17B10
SCHEMBL10624847 0.85 KDM4E (0.52) POLBHTTKDM4EGAAHSD17B10
SCHEMBL9596191 0.83 HTT (0.47) POLBHTTKDM4EGAAHSD17B10
SCHEMBL8600788 0.82 HTT (0.47) POLBHTTKDM4EGAAHSD17B10
SCHEMBL721909 0.82 HTT (0.59) POLBHTTKDM4EGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109970553-A A method of preparing 2,3,5- trimethylhydroquinone diester 万华化学集团股份有限公司 2019-07-05 — — CN claimed
CN-106565659-B A method of preparing vitamin e acetate 万华化学集团股份有限公司 2019-06-18 — — CN claimed
CN-109705082-A A method of preparing vitamin e acetate 万华化学集团股份有限公司 2019-05-03 — — CN claimed
CN-108047042-A A kind of method using high-gravity technology synthesis 2,3,5- trimethylhydroquinone diester 浙江新和成药业有限公司 2018-05-18 — — CN claimed
CN-106565659-A Method of preparing vitamin E acetate 万华化学集团股份有限公司 2017-04-19 — — CN claimed
CN-102180793-B Method for synthesizing 2,3,5-trimethylhydroquinone diester ZHEJIANG NHU PHARMACEUTICAL CO LTD 2014-08-27 — — CN claimed
CN-102659580-B Preparation method and crystallization method of 2, 3, 5-tri-methyl hydroquinone diester new crystal UNIV TIANJIN 2014-01-15 — — CN claimed
EP-1239045-B1 Process for the manufacture of a vitamin E intermediate DSM IP ASSETS BV (NL) 2010-08-25 — — EP claimed
EP-1268390-B1 A PROCESS FOR PREPARING TRIMETHYLHYDROQUINONE DIACETATE AND TRIMETHYLHYDROQUINONE DEGUSSA (DE) 2004-02-18 — — EP claimed
CN-109970553-A A method of preparing 2,3,5- trimethylhydroquinone diester 万华化学集团股份有限公司 2019-07-05 — — CN disclosed
CN-106565659-B A method of preparing vitamin e acetate 万华化学集团股份有限公司 2019-06-18 — — CN disclosed
EP-3330247-B1 CATALYTIC OXIDATION OF 3,5,5-TRIMETHYLCYCLOHEXA-3-ENE-1-ONE (BETA-ISOPHORONE) WITH HYDROGEN PEROXIDE TO 2,6,6-TRIMETHYL-2-CYCLOHEXENE-1,4-DION (KETO ISOPHORONE) EVONIK DEGUSSA GMBH (DE) 2019-05-08 — — EP disclosed
CN-109705082-A A method of preparing vitamin e acetate 万华化学集团股份有限公司 2019-05-03 — — CN disclosed
CN-109705082-A A method of preparing vitamin e acetate 万华化学集团股份有限公司 2019-05-03 — — CN disclosed
EP-0225347-B2 POLYESTER YARN AND METHOD FOR PREPARING IT SCHWEIZERISCHE VISCOSE (CH) 1997-08-13 — — EP disclosed
EP-0225347-B1 POLYESTER YARN AND METHOD FOR PREPARING IT RHONE-POULENC VISCOSUISSE SA (CH) 1992-08-26 — — EP disclosed
EP-0225347-A1 POLYESTER YARN AND METHOD FOR PREPARING IT. SCHWEIZERISCHE VISCOSE (CH) 1987-06-16 — — EP disclosed
WO-1986007616-A1 METHOD FOR PREPARING MODIFIED POLYESTER YARNS AND POLYESTER YARN OBTAINED THEREBY VISCOSUISSE SA (CH) 1986-12-31 — — WO disclosed
EP-0087576-B1 PROCESS FOR PREPARING TOCOPHERYL ACETATE OR TOCOPHERYL PROPIONATE BASF Aktiengesellschaft (DE) 1986-11-20 — — EP disclosed
EP-0087576-A1 Process for preparing tocopheryl acetate or tocopheryl propionate BASF Aktiengesellschaft (DE) 1983-09-07 — — EP disclosed
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