SCHEMBL4450031

SCHEMBL4450031

Nc1cc(Br)cc(Br)c1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 2/20 0.39
HTT P42858 1/20 0.39
APEX1 P27695 1/20 0.38
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35
MAPT P10636 3/20 0.35
GAA P10253 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
AKR1B1 P15121 3/20 0.34
ALOX15 P16050 5/20 0.33
ALOX12 P18054 3/20 0.33
AHR P35869 1/20 0.33
POLB P06746 2/20 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
SCHEMBL6660944 0.77 APEX1 (0.60) TDP1CYP3A4TSHRKMT2AHTT
SCHEMBL1612647 0.77 GAA (0.48) TDP1CYP3A4TSHRKMT2AHTT
SCHEMBL28861522 0.77 MAPT (0.55) TDP1CYP3A4TSHRKMT2AAPEX1
SCHEMBL29674869 0.77 GAA (0.48) TDP1CYP3A4TSHRKMT2AHTT
SCHEMBL9388166 0.77 GAA (0.48) TDP1CYP3A4TSHRKMT2AHTT
Hydrochloric Acid SCHEMBL4380306 0.74 GAA (0.46) TDP1CYP3A4TSHRKMT2AHTT
SCHEMBL6675090 0.73 TDP1 (0.43) TDP1CYP3A4TSHRKMT2AAPEX1
SCHEMBL25241106 0.72 ALDH1A1 (0.39) IDO1TDO2AKR1B1CA1CA2
SCHEMBL7643820 0.72 CYP3A4 (0.38) TDP1CYP3A4TSHRKMT2AHTT
SCHEMBL11591522 0.72 NSD1 (0.39) TDP1CYP3A4TSHRGABRA1GABRB1

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
CN-108701832-B Polymer compound, negative electrode, method for producing negative electrode, intermediate composition, electricity storage device, and slurry for negative electrode 株式会社丰田自动织机 2020-06-16 CN disclosed
US-10351672-B2 Polymer compound formed by condensing polyacrylic acid, polyamine and aromatic monoamine, intermediate composition, negative electrode, electrical storage device, slurry for negative electrode, method for producing polymer compound, and method for producing negative electrode KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2019-07-16 US disclosed
US-20190040199-A1 POLYMER COMPOUND, INTERMEDIATE COMPOSITION, NEGATIVE ELECTRODE, ELECTRICAL STORAGE DEVICE, SLURRY FOR NEGATIVE ELECTRODE, METHOD FOR PRODUCING POLYMER COMPOUND, AND METHOD FOR PRODUCING NEGATIVE ELECTRODE KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2019-02-07 US disclosed
CN-108701832-A Polymer compound, intermediate composition, negative electrode, electricity storage device, slurry for negative electrode, method for producing polymer compound, and method for producing negative electrode 株式会社丰田自动织机 2018-10-23 CN disclosed
EP-2035459-B1 COVALENT CONJUGATES OF COTTON AND SUBSTITUTES (VISCOSE, MODAL COTTON) WITH BIOACTIVE SUBSTANCES HAVING ANTISEPTIC, SANITIZING, ACARICIDAL AND INSECT REPELLENT ACTIVITY, AND A METHOD FOR OBTAINING THEM FRANZONI FILATI S P A (IT) 2009-12-16 EP disclosed
EP-2035459-A2 COVALENT CONJUGATES OF COTTON AND SUBSTITUTES (VISCOSE, MODAL COTTON) WITH BIOACTIVE SUBSTANCES HAVING ANTISEPTIC, SANITIZING, ACARICIDAL AND INSECT REPELLENT ACTIVITY, AND A METHOD FOR OBTAINING THEM Franzoni Filati S.p.A. (IT) 2009-03-18 EP disclosed
WO-2007135548-A2 COVALENT CONJUGATES OF COTTON AND SUBSTITUTES (VISCOSE, MODAL COTTON) WITH BIOACTIVE SUBSTANCES HAVING ANTISEPTIC, SANITIZING, ACARICIDAL AND INSECT REPELLENT ACTIVITY, AND A METHOD FOR OBTAINING THEM FRANZONI FILATI S.P.A. (IT) 2007-11-29 WO disclosed
EP-0215312-B1 METHOD FOR PRODUCING OF POLYARYLENE SULFIDES IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1992-03-25 EP disclosed
US-4810773-A HIGH MOLECULAR WEIGHT ENGINEERING THERMOPLASTICS IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1989-03-07 US disclosed