SCHEMBL332433

SCHEMBL332433

CC(O)CC(C)(C)[O]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL4114121 0.75
SCHEMBL443754 0.73
SCHEMBL441789 0.73
SCHEMBL2329755 0.73
SCHEMBL195392 0.73
SCHEMBL1401735 0.73
Hexylene Glycol SCHEMBL19379 0.71
Hexylene Glycol SCHEMBL6869929 0.71 MAPK1 (0.39)
Hexylene Glycol SCHEMBL335683 0.71
SCHEMBL955102 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2081941-B1 MERCAPTO-FUNCTIONAL SILANE COMPOSITIONS HAVING REDUCED VOC LEVELS MOMENTIVE PERFORMANCE MAT INC (US) 2015-03-18 EP disclosed
EP-1996597-B1 PROCESS FOR MAKING ORGANOFUNCTIONAL SILANES AND MIXTURES THEREOF MOMENTIVE PERFORMANCE MAT INC (US) 2014-10-15 EP disclosed
EP-1989265-B1 FREE FLOWING FILLER COMPOSITON BASED ON ORGANOFUNCTIONAL SILANE MOMENTIVE PERFORMANCE MAT INC (US) 2014-05-07 EP disclosed
EP-2332945-B9 Organofunctional silanes and their mixtures MOMENTIVE PERFORMANCE MAT INC (US) 2013-05-29 EP disclosed
EP-2332945-B1 Organofunctional silanes and their mixtures MOMENTIVE PERFORMANCE MAT INC (US) 2012-12-19 EP disclosed
EP-2086988-B1 MERCAPTOFUNCTIONAL SILANE AND PROCESS FOR ITS PREPARATION MOMENTIVE PERFORMANCE MAT INC (US) 2012-12-12 EP disclosed
US-8097744-B2 Free flowing filler composition comprising mercapto-functional silane MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2012-01-17 US disclosed
US-8008519-B2 Process for making mercapto-functional silane MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2011-08-30 US disclosed
EP-2332945-A1 Organofunctional silanes and their mixtures Momentive Performance Materials Inc. (US) 2011-06-15 EP disclosed
US-7919650-B2 Organofunctional silanes and their mixtures MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2011-04-05 US disclosed
US-20080039561-A1 Free flowing filler composition comprising mercapto-functional silane GENERAL ELECTRIC COMPANY (US) 2008-02-14 US disclosed
US-20080039644-A1 Process for making mercapto-functional silane GENERAL ELECTRIC COMPANY (US) 2008-02-14 US disclosed
US-20070228322-A1 Free flowing filler composition based on organofunctional silane MOMENTIVE PERFORMANCE MATERIALS INC. 2007-10-04 US disclosed
WO-2007100532-A2 RUBBER COMPOSITION CONTAINING ORGANOFUNCTIONAL SILANE MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2007-09-07 WO disclosed
WO-2007098120-A2 PROCESS FOR MAKING ORGANOFUNCTIONAL SILANES AND MIXTURES THEREOF MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2007-08-30 WO disclosed
WO-2007098121-A2 ORGANOFUNCTIONAL SILANES AND THEIR MIXTURES MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2007-08-30 WO disclosed
WO-2007098080-A2 FREE FLOWING FILLER COMPOSITION BASED ON ORGANOFUNCTIONAL SILANE MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2007-08-30 WO disclosed
US-20070197813-A1 Process for making organofunctional silanes and mixtures thereof MOMENTIVE PERFORMANCE MATERIALS INC. 2007-08-23 US disclosed
US-20070197812-A1 Organofunctional silanes and their mixtures MOMENTIVE PERFORMANCE MATERIALS INC. 2007-08-23 US disclosed
US-20070197725-A1 Rubber composition containing organofunctional silane MOMENTIVE PERFORMANCE MATERIALS INC. 2007-08-23 US disclosed