SCHEMBL486034

SCHEMBL486034

C1=C2CCCCC2C2CCCCC2=C1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
TLR4 O00206 1/20 0.35
KDM1A O60341 1/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP19A1 P11511 2/20 0.31

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
SCHEMBL8741460 0.81 TLR4 (0.34) TLR4CYP19A1
SCHEMBL6595832 0.79
SCHEMBL821855 0.78
SCHEMBL11702792 0.78
SCHEMBL6239420 0.77 TDO2 (0.31)
SCHEMBL31285765 0.76 KDM1A (0.40) TLR4KDM1AKDM4EPOLBL3MBTL1
Hydrazine SCHEMBL1572402 0.75 KDM1A (0.30) KDM1A
SCHEMBL1821880 0.73
SCHEMBL6811753 0.73 KDM1A (0.34) KDM1A
SCHEMBL19003295 0.73 KDM4E (0.31) ESR1ESR2KDM4EPOLBL3MBTL1

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
US-5122498-A Hydrogenated phenanthrene and anthracene as solvents for leuco dyes; high dissolving power NKK CORPORATION (JP) 1992-06-16 US claimed
US-20230009398-A1 NOVEL GLUTAMINE ANTAGONISTS AND USES THEREOF Ústav organické chemie a biochemie AV CR, v.v.i. (CZ) 2023-01-12 US disclosed
EP-3692015-B1 NOVEL GLUTAMINE ANTAGONISTS AND USES THEREOF UNIV JOHNS HOPKINS (US) 2022-08-24 EP disclosed
CN-110418808-B Photocrosslinkable polymer, insulating film, planarizing film, lyophilic-lyophilic patterned film, and organic field effect transistor device comprising same 东曹株式会社 2022-07-15 CN disclosed
CN-111100707-B Hydrocracking method for producing chemical material and fuel oil 中国石油化工股份有限公司 2022-04-08 CN disclosed
CN-111100706-B Hydrocracking method for producing fuel oil 中国石油化工股份有限公司 2022-04-08 CN disclosed
CN-110540875-B Process for producing high density jet fuel and clean diesel 中国石油化工股份有限公司 2022-03-11 CN disclosed
CN-111117699-B Hydrogenation method for producing high-quality jet fuel 中国石油化工股份有限公司 2022-01-04 CN disclosed
CN-111117700-B Method for producing heavy naphtha and jet fuel 中国石油化工股份有限公司 2022-01-04 CN disclosed
CN-111117702-B Hydrocracking method for increasing yield of heavy naphtha and jet fuel fraction 中国石油化工股份有限公司 2022-01-04 CN disclosed
US-7067179-B1 Fused ring compound DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-06-27 US disclosed
EP-1201632-B1 FUSED RING COMPOUND DAINIPPON INK & CHEMICALS (JP) 2006-03-29 EP disclosed
EP-1201632-A1 FUSED RING COMPOUND DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-05-02 EP disclosed
WO-1999020267-A1 FURANYL, TETRACYCLIC TRITERPENE DERIVATIVES WITH IMMUNOSUPPRESSANT ACTIVITY MERCK & CO., INC. (US) 1999-04-29 WO disclosed
US-5122498-A Hydrogenated phenanthrene and anthracene as solvents for leuco dyes; high dissolving power NKK CORPORATION (JP) 1992-06-16 US disclosed
WO-1990003353-A1 LIQUID PHASE FLUORINATION EXFLUOR RESEARCH CORPORATION (US) 1990-04-05 WO disclosed
EP-0307941-A2 Microcapsules of pressure-sensitive copying paper NKK CORPORATION (JP) 1989-03-22 EP disclosed
EP-0304809-A1 Perfluorinated butyl derivative compounds AIR PRODUCTS AND CHEMICALS, INC. (US) 1989-03-01 EP disclosed
EP-0063052-A2 Starting pitches for carbon fibers NIPPON OIL CO. LTD. (JP) 1982-10-20 EP disclosed
US-4337142-A USE OF PRODUCT FRACTION AS HYDROGEN-DONOR SOLVENT THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1982-06-29 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-20230009398-A1 NOVEL GLUTAMINE ANTAGONISTS AND USES THEREOF GLUL, PDCD1, CD274 ESR1 4123/4885ESR2 4259/4885TLR4 1230/4885

“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.