SCHEMBL3156904

SCHEMBL3156904

CC(=O)Oc1c(C)cc(C)cc1C

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.52
▸ HTT P42858 2/20 0.52
▸ HSD17B10 Q99714 2/20 0.52
▸ TP53 P04637 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ LMNA P02545 2/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ HPGD P15428 1/20 0.46
▸ POLB P06746 1/20 0.44
▸ ACHE P22303 2/20 0.40
▸ BACE1 P56817 1/20 0.40
▸ ELANE P08246 1/20 0.39
▸ RAPGEF4 Q8WZA2 1/20 0.39
▸ PREP P48147 2/20 0.38
▸ CELA1 Q9UNI1 1/20 0.38
▸ TOP1 P11387 1/20 0.38
▸ ABCB11 O95342 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
SCHEMBL3672142 0.84 KDM4E (0.44) KDM4EHTTHSD17B10TP53GAA
SCHEMBL11579831 0.84 KDM4E (0.44) KDM4EHTTHSD17B10TP53GAA
SCHEMBL3600800 0.84 HSD17B10 (0.55) KDM4EHTTHSD17B10TP53GAA
SCHEMBL23809728 0.84 BACE1 (0.52) KDM4EHTTHSD17B10TP53GAA
SCHEMBL15509359 0.83 RAPGEF4 (0.40) KDM4EHTTHSD17B10TP53GAA
SCHEMBL9042745 0.82 KDM4E (0.49) KDM4EHTTHSD17B10TP53GAA
SCHEMBL7233258 0.82 KDM4E (0.49) KDM4EHTTHSD17B10TP53GAA
SCHEMBL10790928 0.82 HTT (0.49) KDM4EHTTHSD17B10TP53GAA
SCHEMBL12299731 0.82 KDM4E (0.49) KDM4EHTTHSD17B10TP53GAA
SCHEMBL7384263 0.82 KDM4E (0.49) KDM4EHTTHSD17B10TP53GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106431897-B A kind of new synthesis process of 2,4,6- trimethylbenzene chloroacetic chloride 宿迁科思化学有限公司 2019-06-04 — — CN claimed
CN-109020936-A A kind of preparation method of Spiromesifen and its intermediate 山东康乔生物科技有限公司 2018-12-18 — — CN claimed
CN-106431897-A New compounding technology for 2,4,6-trimethyl phenylacetyl chloride 宿迁科思化学有限公司 2017-02-22 — — CN claimed
CN-103880985-B Hydrocarbon polymer is with dispersant and prepare the method for dispersion SINOPEC CORP. (CN) 2016-05-04 — — CN claimed
US-4212989-A ARYL ESTER SOLVENTS USED IN CATALYTIC CARBONYLATION FO ALCOHOLS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1980-07-15 — — US claimed
US-11807716-B2 Oligomer (2,6-dimethylphenylene ether) together with fabrication method and cured product thereof CPC CORPORATION, TAIWAN (TW) 2023-11-07 — — US disclosed
CN-106431897-B A kind of new synthesis process of 2,4,6- trimethylbenzene chloroacetic chloride 宿迁科思化学有限公司 2019-06-04 — — CN disclosed
CN-109020936-A A kind of preparation method of Spiromesifen and its intermediate 山东康乔生物科技有限公司 2018-12-18 — — CN disclosed
CN-109020936-A A kind of preparation method of Spiromesifen and its intermediate 山东康乔生物科技有限公司 2018-12-18 — — CN disclosed
CN-107848988-A Alkenyl substituted 2, 5-piperazinediones and their use in compositions for delivering an agent to a subject or cell 麻省理工学院 2018-03-27 — — CN disclosed
EP-2148865-B1 PYRAZOLE INHIBITORS OF WNT SIGNALING GENENTECH INC (US) 2017-05-17 — — EP disclosed
CN-104829418-B Method for preparing benzyl chloride compound 湖南海利化工股份有限公司 2017-05-17 — — CN disclosed
US-20070149574-A1 Novel cyclic compound having 4-pyridylalkylthio group having substituted or unsubstituted amino group introduced therein SANTEN PHARMACEUTICAL CO., LTD. (JP) 2007-06-28 — — US disclosed
US-20070149574-A1 Novel cyclic compound having 4-pyridylalkylthio group having substituted or unsubstituted amino group introduced therein SANTEN PHARMACEUTICAL CO., LTD. (JP) 2007-06-28 — — US disclosed
US-5905068-A Retroviral protease inhibiting compounds ABBOTT LABORATORIES (US) 1999-05-18 — — US disclosed
US-4381221-A Process for recovering a reaction product while preventing decomposition of the catalyst MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1983-04-26 — — US disclosed
EP-0074837-A1 4-Substituted pyridine catalysts REILLY TAR & CHEMICAL CORPORATION (US) 1983-03-23 — — EP disclosed
US-4234733-A PHENOL, ALIPHATIC ESTER OR ETHER, CARBON MONOXIDE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1980-11-18 — — US disclosed
US-4212989-A ARYL ESTER SOLVENTS USED IN CATALYTIC CARBONYLATION FO ALCOHOLS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1980-07-15 — — US disclosed
US-4101391-A Electrolytic oxidative methyl-methyl coupling of cresol salts MONSANTO COMPANY (US) 1978-07-18 — — US 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-20070149574-A1 Novel cyclic compound having 4-pyridylalkylthio group having substituted or unsubstituted amino group introduced therein FLT4, FLT1, TIE1 KDM4E 1390/4885HTT 2163/4885HSD17B10 2594/4885

“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.

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