SCHEMBL4416992

SCHEMBL4416992

CCCCC(CC)COC(C)CO

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.57
CYP3A4 P08684 6/20 0.47
TSHR P16473 4/20 0.47
TDP1 Q9NUW8 3/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 3/20 0.42
CA2 P00918 3/20 0.41
RECQL P46063 1/20 0.40
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
MMP14 P50281 1/20 0.38
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36

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
SCHEMBL30451836 0.96 ALDH1A1 (0.53) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL30452296 0.96 ALDH1A1 (0.53) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL4456713 0.86 ALDH1A1 (0.60) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL12242147 0.86 CYP3A4 (0.52) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL8034700 0.85 ALDH1A1 (0.46) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL4462844 0.84 ALDH1A1 (0.58) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL18860796 0.83 CYP3A4 (0.53) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL102775 0.82 ALDH1A1 (0.59) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL9615438 0.82 CYP3A4 (0.50) ALDH1A1CYP3A4TSHRTDP1ATM
SCHEMBL8646632 0.82 CYP3A4 (0.51) ALDH1A1CYP3A4TSHRTDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130272986-A1 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY (US) 2013-10-17 US claimed
CN-100548121-C Method for treating plant diseases caused by microorganisms PROCTER & GAMBLE (US) 2009-10-14 CN claimed
US-20090215854-A1 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY 2009-08-27 US claimed
US-20090202463-A1 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY ATTN: CHIEF PATENT COUNSEL (US) 2009-08-13 US claimed
US-20090035339-A1 Methods of Inactivating Viruses THIRD STREAM BIOSCIENCE, INC. 2009-02-05 US claimed
CN-1946291-A Method of treating microbial plant diseases PROCTER & GAMBLE (US) 2007-04-11 CN claimed
CN-1946428-A Therapeutic antimicrobial compositions and methods PROCTER & GAMBLE (US) 2007-04-11 CN claimed
EP-1740166-A2 THERAPEUTIC ANTIMICROBIAL COMPOSITIONS AND METHODS The Procter and Gamble Company (US) 2007-01-10 EP claimed
EP-1740046-A2 METHOD OF TREATING MICROBIAL PLANT DISEASES The Procter and Gamble Company (US) 2007-01-10 EP claimed
CN-1745148-A Optical data storage containing phthalocyanine Co with axial substituents and axial coordinating ligands in the optically writable information layer LANXESS DEUTSCHLAND GMBH (DE) 2006-03-08 CN claimed
US-20050271711-A1 Therapeutic antimicrobial compositions and methods THE PROCTER & GAMBLE COMPANY (US) 2005-12-08 US claimed
US-20050260243-A1 Method of treating microbial plant diseases THE PROCTER & GAMBLE COMPANY (US) 2005-11-24 US claimed
WO-2005105070-A2 THERAPEUTIC ANTIMICROBIAL COMPOSITIONS AND METHODS THE PROCTER & GAMBLE COMPANY (US) 2005-11-10 WO claimed
WO-2005104843-A2 METHOD OF TREATING MICROBIAL PLANT DISEASES THE PROCTER & GAMBLE COMPANY (US) 2005-11-10 WO claimed
WO-2004000016-A9 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME PROCTER & GAMBLE (US) 2005-07-14 WO claimed
EP-1515607-A2 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY (US) 2005-03-23 EP claimed
US-20040001797-A1 Mixture of acid, anionic surfactant, calcium scavenger and antifoam agent; bactericides; viricides PROCTER & GAMBLE COMPANY, THE 2004-01-01 US claimed
WO-2004000016-A2 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY (US) 2003-12-31 WO claimed
US-20030235550-A1 Antimicrobial compositions, products and methods employing same PROCTER & GAMBLE COMPANY, THE 2003-12-25 US claimed
US-20130272986-A1 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY (US) 2013-10-17 US disclosed
CN-101563077-A Method for inactivating viruses MICHAEL LYNCH (US) 2009-10-21 CN disclosed
CN-100548121-C Method for treating plant diseases caused by microorganisms PROCTER & GAMBLE (US) 2009-10-14 CN disclosed
US-20090215854-A1 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY 2009-08-27 US disclosed
EP-2091528-A2 METHODS OF INACTIVATING VIRUSES Lynch, Michael (US) 2009-08-26 EP disclosed
US-20090202463-A1 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY ATTN: CHIEF PATENT COUNSEL (US) 2009-08-13 US disclosed
US-7569530-B1 Antimicrobial compositions, products and methods employing same THE PROCTER & GAMBLE COMPANY (US) 2009-08-04 US disclosed
US-20090035339-A1 Methods of Inactivating Viruses THIRD STREAM BIOSCIENCE, INC. 2009-02-05 US disclosed
WO-2008045860-A2 METHODS OF INACTIVATING VIRUSES LYNCH MICHAEL (US) 2008-04-17 WO disclosed
CN-1745148-A Optical data storage containing phthalocyanine Co with axial substituents and axial coordinating ligands in the optically writable information layer LANXESS DEUTSCHLAND GMBH (DE) 2006-03-08 CN disclosed
WO-2004000016-A9 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME PROCTER & GAMBLE (US) 2005-07-14 WO disclosed
EP-1515607-A2 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY (US) 2005-03-23 EP disclosed
US-20040001797-A1 Mixture of acid, anionic surfactant, calcium scavenger and antifoam agent; bactericides; viricides PROCTER & GAMBLE COMPANY, THE 2004-01-01 US disclosed
WO-2004000016-A2 ANTIMICROBIAL COMPOSITIONS, PRODUCTS AND METHODS EMPLOYING SAME THE PROCTER & GAMBLE COMPANY (US) 2003-12-31 WO disclosed
US-20030235550-A1 Antimicrobial compositions, products and methods employing same PROCTER & GAMBLE COMPANY, THE 2003-12-25 US disclosed
US-20030235550-A1 Antimicrobial compositions, products and methods employing same PROCTER & GAMBLE COMPANY, THE 2003-12-25 US disclosed