SCHEMBL1078987

SCHEMBL1078987

C=C(C)C(OC(C(=C)C)(c1ccccc1)S(=O)(=O)O)(c1ccccc1)S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.36
KCNN4 O15554 1/20 0.35
CYP2C19 P33261 2/20 0.35
ALDH1A1 P00352 2/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 2/20 0.34
CYP2D6 P10635 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 2/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CES1 P23141 1/20 0.33
MAPT P10636 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA5A P35218 1/20 0.32
CA9 Q16790 1/20 0.32
HIF1A Q16665 1/20 0.32
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
SCHEMBL28297532 0.73 CES1 (0.44) PTPN1KCNN4CYP2C19ALDH1A1ALOX15
SCHEMBL7720222 0.72 PAX8 (0.33) CYP2C19HTTKMT2AHPGDTSHR
SCHEMBL27940396 0.68 KCNN4 (0.43) PTPN1KCNN4CYP2C19ALDH1A1ALOX15
SCHEMBL8341874 0.68 CYP2D6 (0.38) PTPN1CYP2C19ALDH1A1MAPK1CYP2D6
SCHEMBL27587592 0.68 CYP1A2 (0.38) PTPN1KCNN4CYP2C19HTTKMT2A
Hydrochloric Acid SCHEMBL28312050 0.68 PTPN1 (0.44) PTPN1KCNN4CYP2C19ALDH1A1ALOX15
SCHEMBL29619 0.66 MAPT (0.45) PTPN1KCNN4CYP2C19ALDH1A1ALOX15
Tert-Butylbenzene SCHEMBL28546408 0.66 ALDH1A1 (0.47) CYP2C19ALDH1A1ALOX15KMT2ATSHR
SCHEMBL10940867 0.66 KCNN4 (0.46) PTPN1KCNN4ALDH1A1MAPK1CYP2D6
SCHEMBL11456801 0.66 CYP1A2 (0.39) KCNN4CYP2C19ALDH1A1MAPK1CYP2D6

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008076602-A1 METHOD OF MAKING MIXED MATRIX MEMBRANES UOP LLC (US) 2008-06-26 WO claimed
JP-4041707-A None JP disclosed
JP-4041708-A None JP disclosed
CN-117980273-A Solid phosphorus-free scale and corrosion inhibitor composition for cooling water treatment 埃科莱布美国股份有限公司 2024-05-03 CN disclosed
US-20230087114-A1 SOLID, NON-PHOSPHOROUS, SCALE AND CORROSION INHIBITOR COMPOSITION FOR COOLING WATER TREATMENT ECOLAB USA INC. 2023-03-23 US disclosed
WO-2023043798-A1 SOLID, NON-PHOSPHOROUS, SCALE AND CORROSION INHIBITOR COMPOSITION FOR COOLING WATER TREATMENT ECOLAB USA INC. (US) 2023-03-23 WO disclosed
WO-2019046291-A1 DEAD END MEMBRANE GAS SEPARATION PROCESS AIR LIQUIDE ADVANCED TECHNOLOGIES U.S. LLC (US) 2019-03-07 WO disclosed
EP-3328965-A1 PROCESS FOR PREPARING A PARAFFIN PRODUCT SHELL INTERNATIONAL RESEARCH MAATSCHAPPIJ B.V. (NL) 2018-06-06 EP disclosed
EP-3063311-B1 CORROSION INHIBITING COMPOSITIONS AND METHODS U S WATER SERVICES INC (US) 2018-04-11 EP disclosed
US-9663748-B2 Freestanding detergent composition not requiring an automated dispenser ECOLAB USA INC. (US) 2017-05-30 US disclosed
EP-1708979-A1 XYLENE PROCESS USING PERM-SELECTIVE SEPARATIONS BP Corporation North America Inc. (US) 2006-10-11 EP disclosed
EP-1708980-A1 PARA-XYLENE PROCESS USING PERM -SELECTIVE SEPARATIONS BP Corporation North America Inc. (US) 2006-10-11 EP disclosed
US-20050202995-A1 Methods of treating surfaces using surface-treating compositions containing sulfonated/carboxylated polymers THE PROCTER & GAMBLE COMPANY (US) 2005-09-15 US disclosed
US-20050202996-A1 Surface-treating compositions containing sulfonated/carboxylated polymers THE PROCTER & GAMBLE COMPANY (US) 2005-09-15 US disclosed
WO-2005075389-A1 XYLENE PROCESS USING PERM-SELECTIVE SEPARATIONS BP CORPORATION NORTH AMERICA INC. (US) 2005-08-18 WO disclosed
WO-2005075390-A1 PARA-XYLENE PROCESS USING PERM -SELECTIVE SEPARATIONS BP CORPORATION NORTH AMERICA INC. (US) 2005-08-18 WO disclosed
JP-H0441708-A PRODUCTION OF ACRYLIC FIBER HAVING HIGH WATER RETENTION RATIO MITSUBISHI RAYON CO LTD 1992-02-12 JP disclosed
JP-H0441707-A PRODUCTION OF ACRYLIC FIBER HAVING HIGH WATER RETENTION RATIO MITSUBISHI RAYON CO LTD 1992-02-12 JP disclosed
EP-0099868-A1 Membrane gas separation processes MONSANTO COMPANY (US) 1984-02-01 EP disclosed
EP-0009385-B1 PROCESS FOR METHANOL PRODUCTION MONSANTO COMPANY (US) 1983-01-05 EP disclosed