SCHEMBL4611380

SCHEMBL4611380

O=C(c1cccc2ccccc12)P(=O)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.53
NR4A2 P43354 1/20 0.53
NR4A3 Q92570 1/20 0.53
MMP3 P08254 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
CDC25B P30305 1/20 0.47
PLK1 P53350 1/20 0.47
PTK2B Q14289 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PTPN1 P18031 1/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
BCL2 P10415 1/20 0.43
MCL1 Q07820 1/20 0.43
BAD Q92934 1/20 0.43
SRC P12931 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 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
SCHEMBL4609824 0.84 KMT2A (0.49) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL4610568 0.80 PLK1 (0.54) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL4610744 0.77 NR4A1 (0.49) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL4610305 0.77 PTK2B (0.67) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL779617 0.77 HPGD (0.46) L3MBTL1ALDH1A1HPGDSRCKDM4E
SCHEMBL11515536 0.76 KDM4E (0.50) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL4609949 0.76 PLK1 (0.50) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL4610651 0.76 HPGD (0.54) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL68477 0.75 NR4A1 (0.58) NR4A1NR4A2NR4A3MMP3HDAC8
SCHEMBL30039374 0.75 NR4A1 (0.58) NR4A1NR4A2NR4A3MMP3HDAC8

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
EP-1419182-B1 IRON-BASED CATALYST COMPOSITION FOR THE MANUFACTURE OF SYNDIOTACTIC 1,2-POLYBUTADIENE BRIDGESTONE CORP (JP) 2008-10-15 EP disclosed
CN-1293102-C Iron-based catalyst composition for producing syndiotactic 1, 2-polybutadiene BRIDGESTONE CORP (JP) 2007-01-03 CN disclosed
CN-1527844-A Iron-based catalyst composition for the manufacture of syndiotactic 1.2-polybutadiene ������������ʽ���� 2004-09-08 CN 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