SCHEMBL716989

SCHEMBL716989

C#Cc1ccc(C(Cl)Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
HDAC8 Q9BY41 2/20 0.40
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
KEAP1 Q14145 1/20 0.32
PTPN1 P18031 1/20 0.32
PGK1 P00558 1/20 0.32
PGK2 P07205 1/20 0.32
CYP2C9 P11712 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 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
SCHEMBL30080234 0.78 HDAC8 (0.43) TSHRHDAC8CA12CA1CA2
SCHEMBL10800210 0.78 HDAC8 (0.43) HDAC8CA12CA1CA2CA4
SCHEMBL28871 0.76 HDAC8 (0.59) HDAC8CA12CA1CA2CA4
SCHEMBL5075045 0.76 TSHR (0.67) TSHRPGK1PGK2ESR1ESR2
SCHEMBL8992406 0.76 HDAC8 (0.42) HDAC8CA12CA1CA2CA4
SCHEMBL24017079 0.74 DPP4 (0.43) HDAC8CA12CA1CA2CA4
SCHEMBL13832177 0.74 HDAC8 (0.40) HDAC8CA12CA1CA2CA4
SCHEMBL2010094 0.74 DPP4 (0.43) HDAC8CA12CA1CA2CA4
SCHEMBL24017078 0.74 DPP4 (0.43) HDAC8CA12CA1CA2CA4
SCHEMBL1342407 0.74 CYP19A1 (0.47) TSHRCA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109626353-A A kind of cm size grade graphite alkene and its preparation method and application using the synthesis of liquid-liquid interface polymerization reaction 中山大学 2019-04-16 CN disclosed
US-8445141-B2 Sulfonic acid group-containing polymer, method for producing the same, resin composition containing such sulfonic acid group-containing polymer, polymer electrolyte membrane, polymer electrolyte membrane/electrode assembly, and fuel cell TOYO BOSEKI KABUSHIKI KAISHA (JP) 2013-05-21 US disclosed
US-8216727-B2 Aromatic hydrocarbon based proton exchange membrane and direct methanol fuel cell using same TOYO BOSEKI KABUSHIKI KAISHA (JP) 2012-07-10 US disclosed
US-20120052411-A9 AROMATIC HYDROCARBON BASED PROTON EXCHANGE MEMBRANE AND DIRECT METHANOL FUEL CELL USING SAME TOYO BOSEKI KABUSHIKI KAISHA (JP) 2012-03-01 US disclosed
US-20090075147-A1 Sulfonic acid group-containing polymer, method for producing the same, resin composition containing such sulfonic acid group-containing polymer, polymer electrolyte membrane, polymer electrolyte membrane/electrode assembly, and fuel cell TOYO BOSEKI KABUSHIKI KAISHA (JP) 2009-03-19 US disclosed
EP-1889863-A1 SULFONIC ACID GROUP-CONTAINING POLYMER, METHOD FOR PRODUCING SAME, RESIN COMPOSITION CONTAINING SUCH SULFONIC ACID GROUP-CONTAINING POLYMER, POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE/ELECTRODE ASSEMBLY, AND FUEL CELL Toyo Boseki Kabushiki Kasisha (JP) 2008-02-20 EP disclosed
US-20070207361-A1 AROMATIC HYDROCARBON BASED PROTON EXCHANGE MEMBRANE AND DIRECT METHANOL FUEL CELL USING SAME TOYO BOSEKI KABUSHIKI KAISHA (JP) 2007-09-06 US disclosed
EP-1826846-A1 AROMATIC HYDROCARBON-BASE PROTON EXCHANGE MEMBRANE AND DIRECT METHANOL FUEL CELL USING SAME Toyo Boseki Kabushiki Kasisha (JP) 2007-08-29 EP disclosed