SCHEMBL780052

SCHEMBL780052

CCOCCOC(OCC)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
TSHR P16473 2/20 0.45
THRB P10828 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.30
PPARA Q07869 2/20 0.30
NPC1 O15118 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TAAR1 Q96RJ0 1/20 0.30
CHRM1 P11229 1/20 0.30
AKR1A1 P14550 1/20 0.30
CHRM3 P20309 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL30065241 0.98 ALDH1A1 (0.43) ALDH1A1TSHRTHRBMEN1KMT2A
SCHEMBL18139977 0.88 ALDH1A1 (0.39) ALDH1A1TSHRTHRBNPC1HPGD
SCHEMBL254504 0.88 ALDH1A1 (0.42) ALDH1A1TSHRTHRB
SCHEMBL18141003 0.87 RARB (0.39) ALDH1A1TSHRTHRBMEN1KMT2A
SCHEMBL18141635 0.87 CES2 (0.39) ALDH1A1TSHRTHRBMEN1KMT2A
SCHEMBL18139158 0.87 RARB (0.39) ALDH1A1TSHRTHRBMEN1KMT2A
SCHEMBL7596202 0.86 EPHX2 (0.33) ALDH1A1TSHR
SCHEMBL6934423 0.86 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL18140351 0.85 CES2 (0.42) TSHRTHRBMEN1KMT2A
SCHEMBL18140194 0.85 CES2 (0.42) TSHRTHRBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877853-B2 Delamination-resistant multilayer container preform, article and method with oxygen barrier formulations GRAHAM PACKAGING COMPANY, LP (US) 2014-11-04 US disclosed
US-20120071600-A1 DELAMINATION-RESISTANT MULTILAYER CONTAINER PREFORM, ARTICLE AND METHOD WITH OXYGEN BARRIER FORMULATIONS GRAHAM PACKAGING COMPANY, LP (US) 2012-03-22 US disclosed
US-8075966-B2 Delamination-resistant multilayer container, preform, article and method with oxygen barrier formulations GRAHAM PACKAGING COMPANY, LTD. (US) 2011-12-13 US disclosed
CN-1261823-B Metal complex used for oxidation and katalysis system PROCTER & GAMBLE 2010-10-27 CN disclosed
EP-1636305-B1 OXYGEN BARRIER FORMULATIONS GRAHAM PACKAGING PET TECH (US) 2009-01-14 EP disclosed
EP-1786684-A1 DELAMINATION-RESISTANT MULTILAYER CONTAINER, PREFORM, ARTICLE AND METHOD WITH OXYGEN BARRIER FORMULATIONS Graham Packaging PET Technologies Inc. (US) 2007-05-23 EP disclosed
CN-1817489-A Ultrasonic cleaning device PROCTER & GAMBLE (US) 2006-08-16 CN disclosed
CN-1262632-C Bleach compositions containing metal bleach catalyst, and bleach activators and/or organic percarboxylic acids PROCTER & GAMBLE (US) 2006-07-05 CN disclosed
EP-1636305-A1 OXYGEN BARRIER FORMULATIONS Graham Packaging PET Technologies Inc. (US) 2006-03-22 EP disclosed
WO-2006012483-A1 DELAMINATION-RESISTANT MULTILAYER CONTAINER, PREFORM, ARTICLE AND METHOD WITH OXYGEN BARRIER FORMULATIONS GRAHAM PACKAGING PET TECHNOLOGIES, INC. (US) 2006-02-02 WO disclosed
CN-1195833-C Cleaning products which uses sonic or ultrasonic waves PROCTER & GAMBLE (US) 2005-04-06 CN disclosed
WO-2004106426-A1 OXYGEN BARRIER FORMULATIONS CONTINENTAL PET TECHNOLOGIES, INC. (US) 2004-12-09 WO disclosed
CN-1333815-A Ultrasonic cleaning composition PROCTER & GAMBLE (US) 2002-01-30 CN disclosed
CN-1333667-A Hand-held cleaning device and cleaning system PROCTER & GAMBLE (US) 2002-01-30 CN disclosed
CN-1333668-A Ultrasonic cleaning equipment PROCTER & GAMBLE (US) 2002-01-30 CN disclosed
CN-1333812-A Cleaning products using sonic or ultrasonic waves PROCTER & GAMBLE (US) 2002-01-30 CN disclosed
CN-1291224-A granular composition with improved dissolution PROCTER & GAMBLE (US) 2001-04-11 CN disclosed
CN-1261823-A Catalyst and method for catalytic oxidation UNIV KANSAS (US) 2000-08-02 CN disclosed
EP-0021177-B1 MAYTANSINOIDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1984-02-08 EP disclosed
US-4308268-A ANTITUMOR, ANTIMITOTIC, FUNGICIDES, ANTIPROTOZOA AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-12-29 US disclosed