SCHEMBL8532305

SCHEMBL8532305

O=S(=O)(O)CCCOCCO.[NaH]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
APP P05067 1/20 0.41
HTT P42858 2/20 0.40
MAPT P10636 2/20 0.40
THRB P10828 1/20 0.40
ALDH1A1 P00352 3/20 0.33
LMNA P02545 3/20 0.33
BLM P54132 2/20 0.33
PTGS1 P23219 1/20 0.33
PDE4A P27815 1/20 0.33
SLC6A6 P31641 1/20 0.33
CYP2C19 P33261 1/20 0.33
POLB P06746 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
ALOX15 P16050 1/20 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
SCHEMBL8529768 0.98 MEN1 (0.48) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL11348454 0.98 TSHR (0.48) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL8384077 0.95 MEN1 (0.50) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL29437894 0.95 MEN1 (0.50) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL19640302 0.91 APP (0.48) APPLMNABLMPTGS1PDE4A
SCHEMBL4731267 0.91 APP (0.48) APPLMNABLMPTGS1PDE4A
SCHEMBL16589837 0.89 MEN1 (0.48) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL421993 0.88 APP (0.50) TSHRAPPHTTMAPTALDH1A1
SCHEMBL306715 0.86 TSHR (0.50) TSHRMAPK1MEN1KMT2AAPP
SCHEMBL25299218 0.85 APP (0.48) TSHRMEN1KMT2AAPPHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1066190-C Detergent compsn. comprising soil release agents PROCTER & GAMBLE (US) 2001-05-23 CN disclosed
US-5843878-A Detergent compositions comprising soil release agents PROCTER & GAMBLE COMPANY (US) 1998-12-01 US disclosed
EP-0707626-B1 DETERGENT COMPOSITIONS COMPRISING SOIL RELEASE AGENTS PROCTER & GAMBLE (US) 1997-05-02 EP disclosed
EP-0707627-B1 DETERGENT COMPOSITIONS COMPRISING SOIL RELEASE AGENTS PROCTER & GAMBLE (US) 1997-01-08 EP disclosed
CN-1138872-A Detergent composition containing soil release agent PROCTER & GAMBLE (US) 1996-12-25 CN disclosed
CN-1128542-A Detergent compositions comprising soil release agents PROCTER & GAMBLE (US) 1996-08-07 CN disclosed
EP-0707626-A1 DETERGENT COMPOSITIONS COMPRISING SOIL RELEASE AGENTS PROCTER & GAMBLE (US) 1996-04-24 EP disclosed
EP-0707627-A1 DETERGENT COMPOSITIONS COMPRISING SOIL RELEASE AGENTS PROCTER & GAMBLE (US) 1996-04-24 EP disclosed
WO-1995002030-A1 DETERGENT COMPOSITIONS COMPRISING SOIL RELEASE AGENTS THE PROCTER & GAMBLE COMPANY (US) 1995-01-19 WO disclosed
WO-1995002029-A1 DETERGENT COMPOSITIONS COMPRISING SOIL RELEASE AGENTS THE PROCTER & GAMBLE COMPANY (US) 1995-01-19 WO disclosed