SCHEMBL3290589

SCHEMBL3290589

CCCCOC(C)(C)CC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.41
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
CYP3A4 P08684 2/20 0.35
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
ATM Q13315 1/20 0.31
LPAR3 Q9UBY5 3/20 0.30
LPAR1 Q92633 2/20 0.30
LPAR2 Q9HBW0 2/20 0.30
THRB P10828 1/20 0.30

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
SCHEMBL9750843 0.92 TSHR (0.39) TSHRALDH1A1TDP1CA1CA2
SCHEMBL29690099 0.90 LPAR3 (0.41) TSHRALDH1A1TDP1CA1CA2
SCHEMBL29690440 0.90 LPAR3 (0.41) TSHRALDH1A1TDP1CA1CA2
SCHEMBL29690454 0.90 LPAR3 (0.41) TSHRALDH1A1TDP1CA1CA2
SCHEMBL2856530 0.90 LPAR3 (0.41) TSHRALDH1A1TDP1CA1CA2
SCHEMBL8024586 0.90 LPAR3 (0.41) TSHRALDH1A1TDP1CA1CA2
SCHEMBL20476803 0.90 LPAR3 (0.41) TSHRALDH1A1TDP1CA1CA2
SCHEMBL9750935 0.90 LPAR3 (0.41) TSHRALDH1A1TDP1CA1CA2
SCHEMBL8467587 0.85 TSHR (0.44) TSHRALDH1A1TDP1ADRB2ADRB1
SCHEMBL8987497 0.83 ADRB2 (0.39) TSHRALDH1A1ADRB2ADRB1ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1569881-B1 METHOD FOR PRODUCING 1-OLEFINS BY CATALYTICALLY SPLITTING 1-ALKOXYALKANES EVONIK OXENO GMBH (DE) 2009-12-09 EP claimed
US-7342144-B2 Method for producing 1-olefins by catalytically splitting 1-alkoxyalkanes OXENO OLEFINCHEMIE GMBH (DE) 2008-03-11 US claimed
US-20060036121-A1 Method for producing 1-olefins by catalytically splitting 1-alkoxyalkanes OXENO OLEFINCHEMIE GMBH (DE) 2006-02-16 US claimed
EP-1569881-A1 METHOD FOR PRODUCING 1-OLEFINS BY CATALYTICALLY SPLITTING 1-ALKOXYALKANES Oxeno Olefinchemie GmbH (DE) 2005-09-07 EP claimed
WO-2004052809-A1 METHOD FOR PRODUCING 1-OLEFINS BY CATALYTICALLY SPLITTING 1-ALKOXYALKANES OXENO OLEFINCHEMIE GMBH (DE) 2004-06-24 WO claimed
US-20020048808-A1 BIODEGRADATION OF ETHERS USING A BACTERIAL CULTURE SHELL OIL COMPANY 2002-04-25 US claimed
US-6365397-B1 DEGRADES AT LEAST 10% AT A CONCENTRATION OF 0.01 TO 500 PPM AEROBICALLY WITHIN 70 HOURS; BIOREMEDIATION SHELL OIL COMPANY 2002-04-02 US claimed
US-5902734-A BIOREMEDIATION OF GROUND WATER OR WASTE WATER CONTAINING METHYL T-BUTYL ETHER BY INCUBATING UNDER AEROBIC CONDITIONS, PRODUCING CARBON DIOXIDE WITHIN 70 HOURS SHELL OIL COMPANY (US) 1999-05-11 US claimed
US-5750364-A UNDER AEROBIC CONDITIONS SHELL OIL COMPANY (US) 1998-05-12 US claimed
US-11773266-B2 Polymer, molded body, foam, resin composition, and production method for polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-03 US disclosed
US-20230129965-A1 HYDROPHILIC AND OLEOPHOBIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed
CN-110713489-B Heteroaryl SYK inhibitors 勃林格殷格翰国际有限公司 2022-05-31 CN disclosed
US-11046892-B1 Oxidative cracking of hydrocarbons ECOCATALYTIC INC. (US) 2021-06-29 US disclosed
EP-3458450-B1 TETRAHYDROPYRAN DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS SA (ES) 2020-07-01 EP disclosed
EP-0284005-B1 METHOD OF PRODUCTION OF POLYOLEFINS IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1991-12-18 EP disclosed
US-4981930-A POLYMERIZATION CATALYSTS IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1991-01-01 US disclosed
EP-0284005-A2 Method of production of polyolefins IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1988-09-28 EP disclosed
EP-0054805-B1 PROCESS FOR PREPARING TERTIARY OLEFINES EC ERDÖLCHEMIE GMBH (DE) 1985-07-03 EP disclosed
EP-0068218-B1 PROCESS FOR THE PREPARATION OF PURE ALKYL-TERT.-ALKYL ETHERS AND HYDROCARBONACEOUS RAFFINATES FREED FOR THE MAJOR PART FROM ISOOLEFINES AND ALKANOLS BAYER AG (DE) 1984-10-10 EP disclosed
US-4278504-A AMIDES AND ETHER SOLVENT EXTRACTION, DISTILLATION BASF AKTIENGESELLSCHAFT (DE) 1981-07-14 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-11046892-B1 Oxidative cracking of hydrocarbons HAO2, SCO2, GPX4 TSHR 4796/4885ALDH1A1 343/4885TDP1 4577/4885

“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.