SCHEMBL3083354

SCHEMBL3083354

CCc1cc(C)cc(CC)c1OC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.47
ALOX5 P09917 2/20 0.41
BACE1 P56817 1/20 0.41
HTT P42858 4/20 0.40
KDM4E B2RXH2 4/20 0.40
HSD17B10 Q99714 4/20 0.40
TP53 P04637 2/20 0.40
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40
ELANE P08246 1/20 0.39
ALDH1A1 P00352 4/20 0.38
HPGD P15428 1/20 0.38
POLB P06746 1/20 0.38
GLA P06280 1/20 0.37
MAPK1 P28482 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37

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
SCHEMBL3672142 0.90 KDM4E (0.44) LMNAALOX5BACE1HTTKDM4E
SCHEMBL27671451 0.87 LMNA (0.40) LMNAALOX5BACE1HTTKDM4E
SCHEMBL27865228 0.87 LMNA (0.40) LMNAALOX5BACE1HTTKDM4E
SCHEMBL14430757 0.84 LMNA (0.44) LMNAALOX5BACE1HTTKDM4E
SCHEMBL5598385 0.84 LMNA (0.44) LMNAALOX5BACE1HTTKDM4E
SCHEMBL27852474 0.83 AKT1 (0.46) LMNAALOX5BACE1HTTKDM4E
SCHEMBL27848174 0.83 LMNA (0.37) LMNAALOX5BACE1HTTKDM4E
SCHEMBL9331500 0.82 HSD17B10 (0.47) LMNABACE1HTTKDM4EHSD17B10
SCHEMBL27865232 0.82 LMNA (0.36) LMNAALOX5BACE1HTTKDM4E
SCHEMBL22498754 0.82 MGAM (0.38) LMNAHTTKDM4EGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110330422-A A kind of preparation method of 2,6- diethyl -4- methylphenyl acetic acid 江苏中旗科技股份有限公司 2019-10-15 CN claimed
CN-109096106-A A kind of preparation method of pinoxaden key intermediate 南京齐正化学有限公司 2018-12-28 CN claimed
CN-113121341-A Method for synthesizing 2, 6-diethyl-4-methyl phenylacetate 江苏中旗科技股份有限公司 2021-07-16 CN disclosed
CN-110526927-A A kind of preparation method of pinoxaden JIANGSU FLAG CHEM IND CO LTD 2019-12-03 CN disclosed
CN-110330422-A A kind of preparation method of 2,6- diethyl -4- methylphenyl acetic acid 江苏中旗科技股份有限公司 2019-10-15 CN disclosed
CN-110330422-A A kind of preparation method of 2,6- diethyl -4- methylphenyl acetic acid 江苏中旗科技股份有限公司 2019-10-15 CN disclosed
CN-109096106-A A kind of preparation method of pinoxaden key intermediate 南京齐正化学有限公司 2018-12-28 CN disclosed
US-8383853-B2 Method for preparing 2,6-diethyl-4-methylphenylacetic acid BAYER CROPSCIENCE AG (DE) 2013-02-26 US disclosed
CN-102014630-A Herbicidal composition comprising a pyridazinone compound with a specific herbicide and a specific safener SUMITOMO CHEMICAL CO 2011-04-13 CN disclosed
US-20100261934-A1 Method for Preparing 2,6-Diethyl-4-Methylphenylacetic Acid BAYER CROPSCIENCE AG (DE) 2010-10-14 US disclosed
CN-101693657-A 2, 6-diethyl-4-methylphenyl substituted tetramic acid derivatives BAYER CROPSCIENCE AG 2010-04-14 CN disclosed
US-20080318776-A1 2,6-Diethyl-4-Methylphenyl-Substituted Tetramic Acid Derivatives BAYER CROPSCIENCE AG (DE) 2008-12-25 US disclosed
CN-101094855-A 2, 6-diethyl-4-methylphenyl substituted tetramic acid derivatives BAYER CROPSCIENCE AG (DE) 2007-12-26 CN 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 (2 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-20100261934-A1 Method for Preparing 2,6-Diethyl-4-Methylphenylacetic Acid DDT, TET1, DDC LMNA 4009/4885ALOX5 1501/4885BACE1 4489/4885
US-20080318776-A1 2,6-Diethyl-4-Methylphenyl-Substituted Tetramic Acid Derivatives DDT, TET1, TET3 LMNA 4223/4885ALOX5 1282/4885BACE1 4236/4885

“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.