SCHEMBL4610237

SCHEMBL4610237

CCCCCCC(C)P(=O)([O-])C(C)CCCCCC.CCCCCCC(C)P(=O)([O-])C(C)CCCCCC.CCCCCCC(C)P(=O)([O-])C(C)CCCCCC.[Fe+3]

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 5/20 0.47
TRPM8 Q7Z2W7 8/20 0.45
GGPS1 O95749 2/20 0.44
LAP3 P28838 1/20 0.44
SMPD1 P17405 3/20 0.42
CA1 P00915 1/20 0.42

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
SCHEMBL672806 0.96 LAP3 (0.48) FDPSTRPM8GGPS1LAP3
SCHEMBL672707 0.96 GGPS1 (0.49) FDPSTRPM8GGPS1LAP3SMPD1
SCHEMBL640849 0.96 FDPS (0.47) FDPSTRPM8GGPS1LAP3SMPD1
SCHEMBL156199 0.96 FDPS (0.47) FDPSTRPM8GGPS1LAP3SMPD1
SCHEMBL3962009 0.96 FDPS (0.47) FDPSTRPM8GGPS1LAP3SMPD1
SCHEMBL672808 0.96 FDPS (0.47) FDPSTRPM8GGPS1LAP3SMPD1
SCHEMBL651322 0.87 FDPS (0.47) FDPSTRPM8GGPS1LAP3SMPD1
SCHEMBL2953027 0.83 FDPS (0.48) FDPSTRPM8GGPS1LAP3SMPD1
SCHEMBL7866714 0.83 LAP3 (0.48) FDPSTRPM8GGPS1LAP3
SCHEMBL150913 0.83 FDPS (0.47) FDPSTRPM8GGPS1LAP3SMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10035908-B1 Process for preparing blends of trans-1,4-polybutadiene and syndiotactic 1,2-polybutadiene BRIDGESTONE CORPORATION (JP) 2018-07-31 US disclosed
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-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
US-6433237-B1 USING COORDINATION CATALYST BRIDGESTONE CORPORATION (JP) 2002-08-13 US disclosed
US-6320004-B1 FORMED BY COMBINING (A) A IRON-CONTAINING COMPOUND; (B) AN ORGANOMAGNESIUM COMPOUND; AND (C) A SILYL PHOSPHONATE; POLYMERIZING CONJUGATED DIENE MONOMERS BRIDGESTONE CORPORATION (JP) 2001-11-20 US disclosed