SCHEMBL514195

SCHEMBL514195

C=CCCC(=O)OCCCC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.55
HPGD P15428 1/20 0.55
DGKA P23743 1/20 0.52
ATM Q13315 1/20 0.48
NAAA Q02083 1/20 0.47
ALDH1A1 P00352 4/20 0.47
HTR2C P28335 1/20 0.46
MGLL Q99685 1/20 0.45
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
CNR1 P21554 1/20 0.44
DNM1 Q05193 1/20 0.43
LMNA P02545 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
FAAH O00519 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
SCHEMBL7557773 0.94 TSHR (0.56) TSHRHPGDDGKANAAAALDH1A1
SCHEMBL9561650 0.93 TSHR (0.59) TSHRHPGDDGKANAAAALDH1A1
SCHEMBL28795347 0.93 TSHR (0.59) TSHRHPGDDGKANAAAALDH1A1
SCHEMBL10942812 0.93 TSHR (0.59) TSHRHPGDDGKANAAAALDH1A1
SCHEMBL513683 0.91 TSHR (0.56) TSHRHPGDDGKAATMNAAA
SCHEMBL514530 0.89 TSHR (0.59) TSHRHPGDDGKAATMNAAA
SCHEMBL515043 0.88 TSHR (0.47) TSHRHPGDDGKANAAAALDH1A1
SCHEMBL3111539 0.87 TSHR (0.62) TSHRHPGDDGKAATMNAAA
SCHEMBL3123509 0.87 TSHR (0.62) TSHRHPGDDGKAATMNAAA
SCHEMBL515244 0.87 TSHR (0.62) TSHRHPGDDGKAATMNAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119798059-A Preparation method of 3-ethylbicyclo [3.2.0] hept-3-en-6-one 江西同和药业股份有限公司 2025-04-11 CN claimed
CN-116082157-A Method for preparing organic carboxylic ester by olefine unsaturated compound alkoxycarbonyl reaction 上海梓龄化工技术有限公司 2023-05-09 CN claimed
CN-113773438-B Carbon dioxide thickener for medium-high permeability oil reservoir and preparation method and technology thereof 德仕能源科技集团股份有限公司 2022-03-08 CN claimed
CN-113773438-A Carbon dioxide thickener for medium-high permeability oil reservoir and preparation method and technology thereof 德仕能源科技集团股份有限公司 2021-12-10 CN claimed
CN-119798059-A Preparation method of 3-ethylbicyclo [3.2.0] hept-3-en-6-one 江西同和药业股份有限公司 2025-04-11 CN disclosed
CN-116082157-A Method for preparing organic carboxylic ester by olefine unsaturated compound alkoxycarbonyl reaction 上海梓龄化工技术有限公司 2023-05-09 CN disclosed
CN-113773438-B Carbon dioxide thickener for medium-high permeability oil reservoir and preparation method and technology thereof 德仕能源科技集团股份有限公司 2022-03-08 CN disclosed
CN-113773438-A Carbon dioxide thickener for medium-high permeability oil reservoir and preparation method and technology thereof 德仕能源科技集团股份有限公司 2021-12-10 CN disclosed
US-10777850-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2020-09-15 US disclosed
US-20190051941-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2019-02-14 US disclosed
US-10177414-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-01-08 US disclosed
EP-3098893-B1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY USING SAME MITSUBISHI CHEM CORP (JP) 2017-11-29 EP disclosed
US-20100227873-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF SCHERING CORPORATION 2010-09-09 US disclosed
US-7737155-B2 Nitrogen-containing heterocyclic compounds and methods of use thereof SCHERING CORPORATION (US) 2010-06-15 US disclosed
US-20080019978-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF SCHERING CORPORATION 2008-01-24 US disclosed
US-20070077197-A1 Metal Complexes Derivatized with Folate for use in Diagnostic and Therapeutic Applications BRACCO INTERNATIONAL B.V. (NL) 2007-04-05 US disclosed
US-5189182-A Catalytic cyclization BASF AKTIENGESELLSCHAFT (DE) 1993-02-23 US disclosed
US-4405469-A SILICON-CARBON BONDS, ESTER GROUPS CONSORTIUM FUR ELEKTROCHEMISCHE IND. GMBH (DE) 1983-09-20 US disclosed
US-4322473-A FIBER COATING CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1982-03-30 US disclosed
US-4207246-A REACTING UNSATURATED DIESTER WITH ORGANOSILOXANE CONTAINING SILICONBONDED HYDROGEN, CATALYST Consortium f/ur Elektrochemische Industrie GmbH (DE) 1980-06-10 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 (3 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-20070077197-A1 Metal Complexes Derivatized with Folate for use in Diagnostic and Therapeutic Applications FOLR1, FOLR2, SLC46A1 TSHR 263/4885HPGD 1394/4885DGKA 2506/4885
US-20080019978-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF CYP11B2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP11B1 TSHR 3516/4885HPGD 112/4885DGKA 4782/4885
US-20100227873-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF CYP11B2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP11B1 TSHR 3516/4885HPGD 112/4885DGKA 4782/4885

“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.