SCHEMBL3048008

SCHEMBL3048008

CCCCn1cc[n+](C)c1.CCOS(=O)(=O)OOCCOC

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
HSP90AA1 P07900 2/20 0.50
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
APAF1 O14727 1/20 0.50
NPC1 O15118 1/20 0.50
PLA2G1B P04054 1/20 0.50
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ATG4B Q9Y4P1 1/20 0.50
FDPS P14324 17/20 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
SCHEMBL4799143 0.81 MAPK1 (0.55) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL294456 0.79 MAPK1 (0.52) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL1617966 0.77 MEN1 (0.56) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL932213 0.77 MEN1 (0.52) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL3954172 0.76 MEN1 (0.52) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL2993834 0.76 SMN1; SMN2 (0.45) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL5446268 0.75 MAPK1 (0.58) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Sulfuric Acid SCHEMBL6744897 0.75 MEN1 (0.51) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL23004434 0.75 MEN1 (0.66) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL23004506 0.75 MEN1 (0.66) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109280186-B Method and composition for curing the surface of uncured polysulfide rubber 波音公司 2022-05-10 CN claimed
US-9776943-B2 Catalyst recovery and recycling process during aromatic carboxylic acid production RELIANCE INDUSTRIES LIMITED (IN) 2017-10-03 US claimed
US-20170166508-A1 A CATALYST RECOVERY AND RECYCLING PROCESS DURING AROMATIC CARBOXYLIC ACID PRODUCTION RELIANCE INDUSTRIES LIMITED (IN) 2017-06-15 US claimed
EP-3107887-A1 A CATALYST RECOVERY AND RECYCLING PROCESS DURING AROMATIC CARBOXYLIC ACID PRODUCTION Reliance Industries Limited (IN) 2016-12-28 EP claimed
WO-2015125096-A1 A CATALYST RECOVERY AND RECYCLING PROCESS DURING AROMATIC CARBOXYLIC ACID PRODUCTION RELIANCE INDUSTRIES LIMITED (IN) 2015-08-27 WO claimed
CN-107532129-B Efficient small volume nucleic acid synthesis 生命技术公司 2022-09-13 CN disclosed
CN-109280186-B Method and composition for curing the surface of uncured polysulfide rubber 波音公司 2022-05-10 CN disclosed
WO-2021153584-A1 EPOXY RESIN COMPOSITION, MOLDING MATERIAL FOR FIBER-REINFORCED COMPOSITE MATERIAL, AND FIBER-REINFORCED COMPOSITE MATERIAL 東レ株式会社 2021-08-05 WO disclosed
CN-105637037-B Conductive composition, conductor, method for forming conductor, and method for producing polymer 三菱化学株式会社 2020-04-14 CN disclosed
US-9776943-B2 Catalyst recovery and recycling process during aromatic carboxylic acid production RELIANCE INDUSTRIES LIMITED (IN) 2017-10-03 US disclosed
US-20170166508-A1 A CATALYST RECOVERY AND RECYCLING PROCESS DURING AROMATIC CARBOXYLIC ACID PRODUCTION RELIANCE INDUSTRIES LIMITED (IN) 2017-06-15 US disclosed
EP-3107887-A1 A CATALYST RECOVERY AND RECYCLING PROCESS DURING AROMATIC CARBOXYLIC ACID PRODUCTION Reliance Industries Limited (IN) 2016-12-28 EP disclosed
WO-2015125096-A1 A CATALYST RECOVERY AND RECYCLING PROCESS DURING AROMATIC CARBOXYLIC ACID PRODUCTION RELIANCE INDUSTRIES LIMITED (IN) 2015-08-27 WO disclosed
WO-2010074886-A2 TISSUE CONDITIONING PROTOCOLS VENTANA MEDICAL SYSTEMS, INC. (US) 2010-07-01 WO disclosed
US-7687513-B1 Aminopyridinium ionic liquids UNIVERSITY OF NOTRE DAME DU LAC (US) 2010-03-30 US disclosed
US-20090170152-A1 Tissue Conditioning Protocols VENTANA MEDICAL SYSTEMS, INC. (US) 2009-07-02 US disclosed