SCHEMBL673852

SCHEMBL673852

Cc1ccc2c(c1C(=O)[O-])Cc1ccccc1O2.Cc1ccc2c(c1C(=O)[O-])Cc1ccccc1O2.[Fe+2]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
ACSL1 P33121 1/20 0.36
MAPKAPK2 P49137 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 2/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
CYP2C19 P33261 1/20 0.32
THPO P40225 1/20 0.32
PMP22 Q01453 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NPC1 O15118 1/20 0.31

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
Lithium Ion SCHEMBL3898744 0.97 MAOA (0.44) MAOAMAOBACSL1MAPKAPK2MEN1
SCHEMBL3890326 0.97 MAOA (0.44) MAOAMAOBACSL1MAPKAPK2MEN1
SCHEMBL11823426 0.97 MAOA (0.44) MAOAMAOBACSL1MAPKAPK2MEN1
SCHEMBL672719 0.97 MAOA (0.44) MAOAMAOBACSL1MAPKAPK2MEN1
Potassium Ion SCHEMBL3888005 0.97 MAOA (0.44) MAOAMAOBACSL1MAPKAPK2MEN1
SCHEMBL11512376 0.97 MAOA (0.44) MAOAMAOBACSL1MAPKAPK2MEN1
SCHEMBL150427 0.97 MAOA (0.44) MAOAMAOBACSL1MAPKAPK2MEN1
SCHEMBL11826523 0.97 MAOA (0.44) MAOAMAOBACSL1MAPKAPK2MEN1
SCHEMBL673811 0.97 MAOA (0.44) MAOAMAOBACSL1MAPKAPK2MEN1
Zinc Ion SCHEMBL15158099 0.97 MAOA (0.44) MAOAMAOBACSL1MAPKAPK2MEN1

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 47 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-6627712-B2 Reaction product of an iron-containing compound, a silyl phosphonate, and an organoaluminum compound to polymerize 1,3-butadiene into syndiotactic 1,2-polybutadiene BRIDGESTONE CORPORATION (JP) 2003-09-30 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-2001049754-A1 CATALYST COMPOSITION AND PROCESS FOR CONTROLLING THE CHARACTERISTICS OF CONJUGATED DIENE POLYMERS 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-2001034669-A1 IRON-BASED CATALYST COMPOSITION AND PROCESS FOR PRODUCING CONJUGATED DIENE POLYMERS BRIDGESTONE CORPORATION (JP) 2001-05-17 WO 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
US-3956473-A Process for oxidizing hydrogen sulfide to sulfur by means of molecular oxygen in the presence of transition metal complexes as catalysts INSTITUT FRANCAIS DU PETROLE, DES CARBURANTS ET LUBRIFIANTS (FR) 1976-05-11 US disclosed