SCHEMBL7048419

SCHEMBL7048419

CC(=O)P(=O)(OC1CCCCC1)OC1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.48
NPSR1 Q6W5P4 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
EPHX1 P07099 2/20 0.37
LMNA P02545 1/20 0.36
NAAA Q02083 2/20 0.34
HTT P42858 1/20 0.33
MMP2 P08253 5/20 0.32
CA12 O43570 4/20 0.32
CA1 P00915 4/20 0.32
CA2 P00918 4/20 0.32
CA9 Q16790 4/20 0.32
MMP8 P22894 1/20 0.32
MMP1 P03956 1/20 0.32
MMP3 P08254 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 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
SCHEMBL4611200 0.98 ACHE (0.45) ACHENPSR1MEN1KMT2AGAA
SCHEMBL4611069 0.93 ACHE (0.41) ACHENPSR1MEN1KMT2AGAA
SCHEMBL4611584 0.80 ACHE (0.43) ACHENPSR1MEN1KMT2AGAA
SCHEMBL28667418 0.78 ACHE (0.44) ACHENPSR1MEN1KMT2AGAA
SCHEMBL4611558 0.78 ACHE (0.44) ACHENPSR1MEN1KMT2AGAA
SCHEMBL4611020 0.78 ACHE (0.40) ACHENPSR1MEN1KMT2AGAA
SCHEMBL4610863 0.78 ACHE (0.44) ACHENPSR1MEN1KMT2AGAA
SCHEMBL4611346 0.78 ACHE (0.44) ACHENPSR1MEN1KMT2AGAA
SCHEMBL4612161 0.77 ACHE (0.42) ACHENPSR1MEN1KMT2AGAA
SCHEMBL4610162 0.77 ACHE (0.42) ACHENPSR1MEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20030073790-A1 Iron-based catalyst composition for the manufacture of syndiotactic 1, 2-polybutadiene BRIDGESTONE CORP. 2003-04-17 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