SCHEMBL330632

SCHEMBL330632

CCCS(=O)(=O)[O-].C[N+](C)(C)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.50
APOBEC3G Q9HC16 1/20 0.50
CA12 O43570 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
PSIP1 O75475 1/20 0.36
BBOX1 O75936 3/20 0.36
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
PABPC1 P11940 1/20 0.35
EIF4H Q15056 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
GAA P10253 1/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33

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
SCHEMBL331078 0.89 CA12 (0.37) APOBEC3AAPOBEC3GCA12CA2CA9
SCHEMBL331179 0.88 APOBEC3A (0.58) APOBEC3AAPOBEC3GCA12CA2CA9
SCHEMBL330745 0.84 PSIP1 (0.39) CA12CA2CA9PSIP1BBOX1
Sulfuric Acid SCHEMBL2386162 0.82 APOBEC3A (0.67) APOBEC3AAPOBEC3GCA12CA2CA9
SCHEMBL330633 0.81 APOBEC3A (0.50) APOBEC3AAPOBEC3GCA12CA9PSIP1
SCHEMBL330485 0.80 APOBEC3A (0.64) APOBEC3AAPOBEC3GCA12CA2CA9
Sulfuric Acid SCHEMBL5345726 0.80 APOBEC3A (0.64) APOBEC3AAPOBEC3GCA12CA2CA9
SCHEMBL331009 0.80 BBOX1 (0.36) CA12CA2CA9BBOX1PABPC1
SCHEMBL330838 0.79 KDM4E (0.57) PSIP1BBOX1GAA
Sulfuric Acid SCHEMBL5345728 0.78 APOBEC3A (0.61) APOBEC3AAPOBEC3GCA12CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005007895-A1 METHODS AND KITS FOR OBTAINING NUCLEIC ACID FROM BIOLOGICAL SAMPLES APPLERA CORPORATION (US) 2005-01-27 WO claimed
US-20050009036-A1 Methods and kits for obtaining nucleic acid from biological samples APPLERA CORPORATION (US) 2005-01-13 US claimed
EP-2295484-B1 POLYMERIZABLE COMPOSITION FOR POLYTHIOURETHANE OPTICAL MATERIAL, POLYTHIOURETHANE OPTICAL MATERIAL OBTAINED FROM SAME POLYMERIZABLE COMPOSITION, AND POLYMERIZATION CATALYST FOR POLYTHIOURETHANE OPTICAL MATERIAL MITSUI CHEMICALS INC (JP) 2018-01-17 EP disclosed
US-9841427-B2 HCV antigen-antibody combination assay and methods and compositions for use therein ABBOTT LABORATORIES (US) 2017-12-12 US disclosed
EP-2407498-B1 Polymerizable composition for polythiourethane optical material, polythiourethane optical material obtained from the polymerizable composition, and polymerization catalyst for polythiourethane optical material MITSUI CHEMICALS INC (JP) 2017-11-15 EP disclosed
US-20170003290-A9 HCV ANTIGEN-ANTIBODY COMBINATION ASSAY AND METHODS AND COMPOSITIONS FOR USE THEREIN ABBOTT LABORATORIES 2017-01-05 US disclosed
US-20160123983-A1 HCV ANTIGEN-ANTIBODY COMBINATION ASSAY AND METHODS AND COMPOSITIONS FOR USE THEREIN ABBOTT LAB (US) 2016-05-05 US disclosed
US-9194873-B2 HCV antigen-antibody combination assay and methods and compositions for use therein ABBOTT LABORATORIES (US) 2015-11-24 US disclosed
US-20140272933-A1 HCV ANTIGEN-ANTIBODY COMBINATION ASSAY AND METHODS AND COMPOSITIONS FOR USE THEREIN ABBOTT LABORATORIES (US) 2014-09-18 US disclosed
US-8304507-B2 Polymerizable composition for polythiourethane optical material, polythiourethane optical material obtained from the polymerizable composition, and polymerization catalyst for polythiourethane optical material MITSUI CHEMICALS, INC. (JP) 2012-11-06 US disclosed
EP-2407498-A2 Polymerizable composition for polythiourethane optical material, polythiourethane optical material obtained from the polymerizable composition, and polymerization catalyst for polythiourethane optical material Mitsui Chemicals, Inc. (JP) 2012-01-18 EP disclosed
US-20110112269-A1 POLYMERIZABLE COMPOSITION FOR POLYTHIOURETHANE OPTICAL MATERIAL, POLYTHIOURETHANE OPTICAL MATERIAL OBTAINED FROM THE POLYMERIZABLE COMPOSITION, AND POLYMERIZATION CATALYST FOR POLYTHIOURETHANE OPTICAL MATERIAL MITSUI CHEMICALS, INC. (JP) 2011-05-12 US disclosed
EP-2295484-A1 POLYMERIZABLE COMPOSITION FOR POLYTHIOURETHANE OPTICAL MATERIAL, POLYTHIOURETHANE OPTICAL MATERIAL OBTAINED FROM SAME POLYMERIZABLE COMPOSITION, AND POLYMERIZATION CATALYST FOR POLYTHIOURETHANE OPTICAL MATERIAL Mitsui Chemicals, Inc. (JP) 2011-03-16 EP disclosed
WO-2005007895-A1 METHODS AND KITS FOR OBTAINING NUCLEIC ACID FROM BIOLOGICAL SAMPLES APPLERA CORPORATION (US) 2005-01-27 WO disclosed
US-20050009036-A1 Methods and kits for obtaining nucleic acid from biological samples APPLERA CORPORATION (US) 2005-01-13 US disclosed