SCHEMBL2385846

SCHEMBL2385846

Cc1c(C)c(C)c2c(sc3c(C)cccc32)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.42
CYP1A2 P05177 3/20 0.42
ALDH1A1 P00352 3/20 0.37
AHR P35869 1/20 0.35
ALKBH5 Q6P6C2 1/20 0.33
FTO Q9C0B1 1/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TRPA1 O75762 1/20 0.32
ATM Q13315 1/20 0.32
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
PARP15 Q460N3 1/20 0.32
PARP10 Q53GL7 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PARP2 Q9UGN5 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 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
SCHEMBL2387412 0.82 CYP2A6 (0.34) CYP2A6CYP1A2ALDH1A1AHRTSHR
SCHEMBL142551 0.82 CYP1A2 (0.55) CYP2A6CYP1A2ALDH1A1AHRALKBH5
SCHEMBL29364650 0.82 CYP1A2 (0.55) CYP2A6CYP1A2ALDH1A1AHRALKBH5
SCHEMBL12211748 0.82 CYP2A6 (0.41) CYP2A6CYP1A2ALDH1A1AHRMAPT
Hydrogen Sulfide SCHEMBL28590036 0.80 CYP1A2 (0.52) CYP2A6CYP1A2ALDH1A1AHRALKBH5
SCHEMBL2388503 0.79 TSHR (0.42) CYP2A6CYP1A2ALDH1A1ALKBH5FTO
SCHEMBL21449415 0.78 MAPT (0.50) CYP2A6CYP1A2ALDH1A1AHRMAPT
SCHEMBL2387356 0.78 CYP2A6 (0.34) CYP2A6CYP1A2ALDH1A1AHRTSHR
SCHEMBL15497403 0.78 CYP1A2 (0.50) CYP2A6CYP1A2ALDH1A1AHRALKBH5
SCHEMBL6130179 0.77 CYP2A6 (0.44) CYP2A6CYP1A2ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105992808-B Use of magnetic nanoparticles for depleting aromatic compounds in oil 综合E&P丹麦股份有限公司 2018-10-19 CN disclosed
US-9969943-B2 Use of magnetic nanoparticles for depletion of aromatic compounds in oil MAERSK OLIE OG GAS A/S (DK) 2018-05-15 US disclosed
CN-105992808-A Use of magnetic nanoparticles for depleting aromatic compounds in oil 马士基橄榄和气体公司 2016-10-05 CN disclosed
US-20160272898-A1 USE OF MAGNETIC NANOPARTICLES FOR DEPLETION OF AROMATIC COMPOUNDS IN OIL TOTAL E&P DANMARK A/S (DK) 2016-09-22 US disclosed
WO-2015044449-A1 USE OF MAGNETIC NANOPARTICLES FOR DEPLETION OF AROMATIC COMPOUNDS IN OIL MÆRSK OLIE OG GAS A/S (DK) 2015-04-02 WO disclosed
CN-101795971-B Solid acid, process for producing the same, and method for desulfurizing hydrocarbon oil using the solid acid as desulfurizing agent JAPAN ENERGY CORP 2012-11-28 CN disclosed
CN-1914298-B Method of desulfurizing hydrocarbon oil JAPAN ENERGY CORP 2012-01-11 CN disclosed
CN-101253256-B Method for desulfurization of hydrocarbon oil JAPAN ENERGY CORP 2011-11-16 CN disclosed
US-8021540-B2 Method of desulfurizing hydrocarbon oil JAPAN ENERGY CORPORATION (JP) 2011-09-20 US disclosed
US-20100227229-A1 SOLID ACID, METHOD FOR PREPARING THE SOLID ACID, AND METHOD FOR DESULFURIZING HYDROCARBON OIL USING THE SOILD ACID AS DESULFURIZING AGENT JAPAN ENERGY CORPORATION (JP) 2010-09-09 US disclosed
CN-101795971-A Solid acid, process for producing the same, and method for desulfurizing hydrocarbon oil using the solid acid as desulfurizing agent JAPAN ENERGY CORP 2010-08-04 CN disclosed
EP-2202204-A1 SOLID ACID, PROCESS FOR PRODUCING THE SOLID ACID, METHOD FOR DESULFURIZING HYDROCARBON OIL USING SOLID ACID AS DESULFURIZING AGENT Japan Energy Corporation (JP) 2010-06-30 EP disclosed
US-20100155303-A1 METHOD FOR DESULFURIZATION OF HYDROCARBON OIL JAPAN ENERGY CORPORATION (JP) 2010-06-24 US disclosed
US-20090000990-A1 Method of Desulfurizing Hydrocarbon Oil JAPAN ENERGY CORPORATION (JP) 2009-01-01 US disclosed
CN-101253256-A Method for desulfurization of hydrocarbon oil JAPAN ENERGY CORP (JP) 2008-08-27 CN disclosed
EP-1923451-A1 METHOD FOR DESULFURIZATION OF HYDROCARBON OIL JAPAN ENERGY CORPORATION (JP) 2008-05-21 EP disclosed
CN-1914298-A Method of desulfurizing hydrocarbon oil JAPAN ENERGY CORP (JP) 2007-02-14 CN disclosed
EP-1715025-A1 METHOD OF DESULFURIZING HYDROCARBON OIL JAPAN ENERGY CORPORATION (JP) 2006-10-25 EP disclosed