SCHEMBL672205

SCHEMBL672205

O=C([O-])c1c(Cc2ccccc2)ccc2c1Cc1ccccc1O2.O=C([O-])c1c(Cc2ccccc2)ccc2c1Cc1ccccc1O2.O=C([O-])c1c(Cc2ccccc2)ccc2c1Cc1ccccc1O2.[Fe+3]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ACSL1 P33121 1/20 0.35
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
HSP90AA1 P07900 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 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
SCHEMBL673696 0.97 MAOA (0.39) MAOAMAOBACSL1HDAC3HDAC4
SCHEMBL153179 0.97 MAOA (0.39) MAOAMAOBACSL1HDAC3HDAC4
SCHEMBL672163 0.97 MAOA (0.39) MAOAMAOBACSL1HDAC3HDAC4
SCHEMBL673859 0.97 MAOA (0.39) MAOAMAOBACSL1HDAC3HDAC4
SCHEMBL11607982 0.97 MAOA (0.39) MAOAMAOBACSL1HDAC3HDAC4
Potassium Ion SCHEMBL7936384 0.97 MAOA (0.39) MAOAMAOBACSL1HDAC3HDAC4
SCHEMBL640816 0.97 MAOA (0.39) MAOAMAOBACSL1HDAC3HDAC4
SCHEMBL4705461 0.90 MAOA (0.43) MAOAMAOBACSL1HSP90AA1TDP1
SCHEMBL28807968 0.86 MAOA (0.40) MAOAMAOBACSL1HSP90AA1TDP1
SCHEMBL673532 0.86 MAOA (0.42) MAOAMAOBACSL1TDP1L3MBTL1

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 43 patents — showing the first 20. 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
US-20120252979-A1 Process for Producing Blends of Syndiotactic, 1,2-Polybutadiene and Rubbery Elastomers RADEMACHER CHRISTINE (US) 2012-10-04 US disclosed
US-8067503-B2 Process for producing blends of syndiotactic, 1,2-polybutadiene and rubbery elastomers BRIDGESTONE CORPORATION (JP) 2011-11-29 US disclosed
EP-1476480-B1 POLYMERIZATION PROCESS FOR PREPARING SYNDIOTACTIC 1,2-POLYBUTADIENE BRIDGESTONE CORP (JP) 2009-07-22 EP disclosed
EP-1419182-B1 IRON-BASED CATALYST COMPOSITION FOR THE MANUFACTURE OF SYNDIOTACTIC 1,2-POLYBUTADIENE BRIDGESTONE CORP (JP) 2008-10-15 EP disclosed
US-20070161748-A1 PROCESS FOR PRODUCING BLENDS OF SYNDIOTACTIC, 1,2-POLYBUTADIENE AND RUBBERY ELASTOMERS BRIDGESTONE CORPORATION 2007-07-12 US disclosed
US-20040242780-A1 using a catalyst that is based on a chromium-containing compound, a hydrogen phosphite, and an organomagnesium compound, or a catalyst based on a molybdenum or iron-compound, a hydrogen phosphite and organoaluminum compound; tire sidewalls; obviates the need for high-temperature mixing BRIDGESTONE CORPORATION (JP) 2004-12-02 US disclosed
EP-1476480-A1 POLYMERIZATION PROCESS FOR PREPARING SYNDIOTACTIC 1,2-POLYBUTADIENE Bridgestone Corporation (JP) 2004-11-17 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-6720397-B2 Using supersaturation solutiton and iron coordination catalyst BRIDGESTONE CORPORATION (JP) 2004-04-13 US disclosed
US-6281305-B1 REACTION PRODUCT OF IRON COMPOUND, PHOSPHITE, HALOGEN COMPOUND AND ORGANOALUMINUM COMPOUND BRIDGESTONE CORPORATION (JP) 2001-08-28 US disclosed
US-20010012878-A1 PREPARATION OF CONJUGATED DIENE POLYMERS BY USING AN IRON-BASED CATALAYST SYSTEM BRIDGESTONE CORPORATION (JP) 2001-08-09 US disclosed
WO-2001049763-A1 PROCESS FOR PRODUCING BLENDS OF SYNDIOTACTIC 1,2-POLYBUTADIENE AND RUBBERY ELASTOMERS WITH AN IRON-BASED CATALYST SYSTEM BRIDGESTONE CORPORATION (JP) 2001-07-12 WO disclosed
WO-2001049755-A1 IRON-BASED CATALYST FOR PRODUCING BINARY Cis-1,4-/1,2-POLYBUTADIENE BRIDGESTONE CORPORATION (JP) 2001-07-12 WO disclosed
WO-2001049753-A1 PREPARATION OF CONJUGATED DIENE POLYMERS BY USING AN IRON-BASED CATALYST SYSTEM BRIDGESTONE CORPORATION (JP) 2001-07-12 WO disclosed
US-20010007000-A1 Process for producing blends of syndiotactic 1,2-polybutadiene and rubbery elastomers with an iron-based catalyst system LUO STEVEN (US) 2001-07-05 US disclosed
WO-2001032724-A1 IRON-BASED CATALYST FOR PRODUCING OLIGOMERS OF CONJUGATED DIENES BRIDGESTONE CORPORATION (JP) 2001-05-10 WO disclosed
US-6211313-B1 COORDINATION COMPOUND OF IRON CONTAINING COMPOUND, PHOSPHITE AND ORGANOALUMINUM COMPOUND BRIDGESTONE CORPORATION (JP) 2001-04-03 US disclosed
US-6197888-B1 FORMED BY COMBINING AN IRON-CONTAINING COMPOUND, A HYDROGEN PHOSPHITE, AND AN ORGANOALUMINUM COMPOUND. BRIDGESTONE CORPORATION (JP) 2001-03-06 US disclosed
US-6160063-A Iron-based catalyst for producing binary cis-1,4-/1,2-polybutadiene BRIDGESTONE CORPORATION (JP) 2000-12-12 US disclosed