SCHEMBL4611267

SCHEMBL4611267

CCCC(=O)P(=O)(OC1CCCCC1)OC1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.44
ACHE P22303 1/20 0.42
EPHX1 P07099 2/20 0.40
NPSR1 Q6W5P4 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HTT P42858 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL4611377 0.98 NAAA (0.42) NAAAACHEEPHX1NPSR1MEN1
SCHEMBL4612143 0.95 NAAA (0.39) NAAAACHEEPHX1NPSR1MEN1
SCHEMBL4610863 0.85 ACHE (0.44) NAAAACHEEPHX1NPSR1MEN1
SCHEMBL4610681 0.83 ACHE (0.41) NAAAACHEEPHX1NPSR1MEN1
SCHEMBL4609962 0.79 ACHE (0.37) NAAAACHEEPHX1NPSR1MEN1
SCHEMBL4609367 0.76 LMNA (0.44) NAAAMEN1KMT2AMMP1MMP2
SCHEMBL7048419 0.75 ACHE (0.48) NAAAACHEEPHX1NPSR1MEN1
SCHEMBL4611200 0.72 ACHE (0.45) NAAAACHEEPHX1NPSR1MEN1
SCHEMBL28667418 0.71 ACHE (0.44) ACHEEPHX1NPSR1MEN1KMT2A
SCHEMBL4611558 0.70 ACHE (0.44) NAAAACHEEPHX1NPSR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1419182-B1 IRON-BASED CATALYST COMPOSITION FOR THE MANUFACTURE OF SYNDIOTACTIC 1,2-POLYBUTADIENE BRIDGESTONE CORP (JP) 2008-10-15 EP disclosed
EP-1419182-A1 IRON-BASED CATALYST COMPOSITION FOR THE MANUFACTURE OF SYNDIOTACTIC 1,2-POLYBUTADIENE Bridgestone Corporation (JP) 2004-05-19 EP disclosed
US-6610804-B2 An iron compound, an alpha-acylphosphonate diester, and an organoaluminum compound BRIDGESTONE CORPORATION (JP) 2003-08-26 US disclosed
US-6576725-B1 Iron compound, organomagnesium compound, and alpha-acylphosphonate diester; addition polymerization BRIDGESTONE CORPORATION (JP) 2003-06-10 US disclosed
US-20030073570-A1 Method of preparing oligomers of conjugated dienes with an iron-based catalyst composition BRIDGESTONE CORP. 2003-04-17 US disclosed
US-20030073790-A1 Iron-based catalyst composition for the manufacture of syndiotactic 1, 2-polybutadiene BRIDGESTONE CORP. 2003-04-17 US disclosed
WO-2003018644-A1 IRON-BASED CATALYST COMPOSITION FOR THE MANUFACTURE OF SYNDIOTACTIC 1,2-POLYBUTADIENE BRIDGESTONE CORPORATION (JP) 2003-03-06 WO disclosed