SCHEMBL4074078

SCHEMBL4074078

CCCCC(CCCC)(CCCC)C(=O)O[Ti](=O)O

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
FDPS P14324 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
EPHX1 P07099 1/20 0.31
ALDH1A1 P00352 1/20 0.30
CES2 O00748 1/20 0.30
CES1 P23141 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
SCHEMBL8411145 0.77 CYP4F2 (0.37) CYP4F2CYP4A11FDPSMEN1MAPT
SCHEMBL10814845 0.76 CYP4F2 (0.39) CYP4F2CYP4A11FDPSMEN1MAPT
SCHEMBL28730000 0.74 EPHX1 (0.43) CYP4F2CYP4A11FDPSMEN1MAPT
SCHEMBL27614308 0.74 CYP4F2 (0.38) CYP4F2CYP4A11FDPSMEN1MAPT
SCHEMBL487483 0.72 CYP4F2 (0.37) CYP4F2CYP4A11FDPSMEN1MAPT
SCHEMBL10779874 0.72 CYP4F2 (0.37) CYP4F2CYP4A11FDPSMEN1MAPT
SCHEMBL2128371 0.72 CYP4F2 (0.37) CYP4F2CYP4A11FDPSMEN1MAPT
SCHEMBL2128373 0.72 CYP4F2 (0.37) CYP4F2CYP4A11FDPSMEN1MAPT
SCHEMBL703088 0.72 CYP4F2 (0.46) CYP4F2CYP4A11FDPSMEN1MAPT
SCHEMBL10777483 0.72 EPHX1 (0.38) CYP4F2CYP4A11MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104379652-B Polarity solubility oxygen-scavenging compositions and goods thereof 碧欧撤曼特克斯有限公司 2016-08-17 CN disclosed
CN-103635536-B Polar soluble oxygen scavenging compositions M&G American Co. (US) 2016-02-24 CN disclosed
CN-104379652-A Polar soluble oxygen scavenging compositions and articles thereof CHEMTEX ITALIA SPA 2015-02-25 CN disclosed
EP-1805243-B1 POLYTRIMETHYLENE TEREPHTHALATE HAVING A LOW LEVEL OF ACROLEIN AND A PROCESS FOR PRODUCING THE SAME LURGI ZIMMER GMBH (DE) 2013-01-09 EP disclosed
US-20120141723-A1 POLYMER FIBER CONTAINING FLAME RETARDANT, PROCESS FOR PRODUCING THE SAME, AND MATERIAL CONTAINING SUCH FIBERS SHELL OIL COMPANY 2012-06-07 US disclosed
EP-2084170-A1 POLYMER FIBER CONTAINING FLAME RETARDANT, PROCESS FOR PRODUCING THE SAME, AND MATERIAL CONTAINING SUCH FIBERS Shell Internationale Research Maatschappij B.V. (NL) 2009-08-05 EP disclosed
EP-2084169-A1 POLYMER COMPOSITION CONTAINING FLAME RETARDANT AND PROCESS FOR PRODUCING THE SAME Shell Internationale Research Maatschappij B.V. (NL) 2009-08-05 EP disclosed
US-20080194793-A1 POLYTRIMETHYLENE TEREPHTHALATE HAVING A LOW LEVEL OF ACROLEIN AND A PROCESS FOR PRODUCING THE SAME KELSEY DONALD ROSS 2008-08-14 US disclosed
US-20080132620-A1 POLYMER COMPOSITION CONTAINING FLAME RETARDANT AND PROCESS FOR PRODUCING THE SAME SHELL OIL COMPANY 2008-06-05 US disclosed
US-7381787-B2 Polytrimethylene terephthalate having a low level of acrolein and a process for producing the same SHELL OIL COMPANY (US) 2008-06-03 US disclosed
WO-2008061075-A1 POLYMER COMPOSITION CONTAINING FLAME RETARDANT AND PROCESS FOR PRODUCING THE SAME SHELL OIL COMPANY (US) 2008-05-22 WO disclosed
WO-2008061087-A1 POLYMER FIBER CONTAINING FLAME RETARDANT, PROCESS FOR PRODUCING THE SAME, AND MATERIAL CONTAINING SUCH FIBERS SHELL OIL COMPANY (US) 2008-05-22 WO disclosed
EP-1805243-A1 POLYTRIMETHYLENE TEREPHTHALATE HAVING A LOW LEVEL OF ACROLEIN AND A PROCESS FOR PRODUCING THE SAME SHELL INTERNATIONAL RESEARCH MAATSCHAPPIJ B.V. (NL) 2007-07-11 EP disclosed
US-20060084783-A1 Polytrimethylene terephthalate having a low level of acrolein and a process for producing the same LURGI ZIMMER GMBH (DE) 2006-04-20 US disclosed
WO-2006033917-A1 POLYTRIMETHYLENE TEREPHTHALATE HAVING A LOW LEVEL OF ACROLEIN AND A PROCESS FOR PRODUCING THE SAME SHELL INTERNATIONAL RESEARCH MAATSCHAPPIJ B.V. (NL) 2006-03-30 WO disclosed
US-4611049-A ORGANOMETALLIC CATALYSTS TEIJIN LIMITED (JP) 1986-09-09 US disclosed