SCHEMBL8569561

SCHEMBL8569561

CC(C)C(O)C(C)(C)CO.CCCCCCOCCOCCO

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
HTT P42858 2/20 0.61
THRB P10828 1/20 0.61
MAPT P10636 1/20 0.61
TSHR P16473 1/20 0.47
USP2 O75604 2/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 1/20 0.43
CASP1 P29466 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SLCO1B3 Q9NPD5 1/20 0.43
SLCO1B1 Q9Y6L6 1/20 0.43
SPHK1 Q9NYA1 1/20 0.39
CES2 O00748 2/20 0.35
CES1 P23141 1/20 0.35
PLA2G2C Q5R387 1/20 0.35
LPAR5 Q9H1C0 1/20 0.34

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
1-Hexanol SCHEMBL10489191 0.88 MEN1 (0.46) MEN1KMT2AHTTTHRBMAPT
SCHEMBL15361789 0.87 TSHR (0.47) MEN1KMT2AHTTTHRBMAPT
Triethylene Glycol SCHEMBL8539657 0.87 MEN1 (0.44) MEN1KMT2AHTTTHRBMAPT
1-Hexanol SCHEMBL10489187 0.84 MEN1 (0.42) MEN1KMT2AHTTTHRBMAPT
Isopropyl Alcohol SCHEMBL10959119 0.82 MEN1 (0.83) MEN1KMT2AHTTTHRBMAPT
Propylene Glycol SCHEMBL5926118 0.79 MEN1 (0.77) MEN1KMT2AHTTTHRBMAPT
Tetraethylene Glycol SCHEMBL23356819 0.78 MEN1 (1.00) MEN1KMT2AHTTTHRBMAPT
Tetraethylene Glycol SCHEMBL23356748 0.78 MEN1 (1.00) MEN1KMT2AHTTTHRBMAPT
Tetraethylene Glycol SCHEMBL23356845 0.78 MEN1 (1.00) MEN1KMT2AHTTTHRBMAPT
Tetraethylene Glycol SCHEMBL23356802 0.78 MEN1 (1.00) MEN1KMT2AHTTTHRBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5726139-A POLYVINYLPYRIDINE OXIDE THE PROCTER & GAMBLE COMPANY (US) 1998-03-10 US disclosed
US-5540865-A CLEANING COMPOUNDS FOR GLASS WITHOUT SPOTTING OR FILMING THE PROCTER & GAMBLE COMPANY (US) 1996-07-30 US disclosed
US-5540864-A ANTISOILANTS THE PROCTER & GAMBLE COMPANY (US) 1996-07-30 US disclosed
US-5534184-A Concentrated liquid hard surface detergent compositions containing maleic acid-olefin copolymers THE PROCTER & GAMBLE COMPANY (US) 1996-07-09 US disclosed
US-5534198-A Glass cleaner compositions having good filming/streaking characteristics and substantive modifier to provide long lasting hydrophilicity THE PROCTER & GAMBLE COMPANY (US) 1996-07-09 US disclosed
US-5454983-A Liquid hard surface detergent compositions containing zwitterionic and cationic detergent surfactants and monoethanolamine and/or beta-aminoalkanol THE PROCTER & GAMBLE COMPANY (US) 1995-10-03 US disclosed
US-5435935-A Alkaline liquid hard-surface cleaning composition containing a quarternary ammonium disinfectant and selected dicarboxylate sequestrants THE PROCTER & GAMBLE COMPANY (US) 1995-07-25 US disclosed
US-5362422-A Glass cleaner THE PROCTER & GAMBLE COMPANY (US) 1994-11-08 US disclosed
US-5342549-A Glass cleaning THE PROCTER & GAMBLE COMPANY (US) 1994-08-30 US disclosed
US-5336445-A Aqueous mixtures with polar solvents for removal of grease and heavy soils from glass without streaking THE PROCTER & GAMBLE COMPANY (US) 1994-08-09 US disclosed
US-5108660-A Hard surface liquid detergent compositions containing hydrocarbyl amidoalkylenesulfobetaine THE PROCTER & GAMBLE COMPANY (US) 1992-04-28 US disclosed