SCHEMBL3854884

SCHEMBL3854884

C=CC(=O)OCCCCC.C=CCOC(=O)C(=C)C

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.61
HPGD P15428 1/20 0.60
ALDH1A1 P00352 4/20 0.51
CYP3A4 P08684 1/20 0.51
HCAR2 Q8TDS4 3/20 0.44
ATM Q13315 1/20 0.42
TP53 P04637 2/20 0.40
HIF1A Q16665 2/20 0.40
HSD17B10 Q99714 1/20 0.40
THRB P10828 2/20 0.39
NAAA Q02083 1/20 0.38
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
EPHX1 P07099 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
SCHEMBL10457292 0.96 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL1952425 0.95 TSHR (0.67) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL3900902 0.94 TSHR (0.66) TSHRHPGDALDH1A1CYP3A4HCAR2
Acrylic Acid Ethyl Ester SCHEMBL7100314 0.92 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL17600586 0.91 TSHR (0.74) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL15130313 0.91 TSHR (0.74) TSHRHPGDALDH1A1CYP3A4HCAR2
1,4-Butanediol SCHEMBL9333775 0.90 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL7959080 0.90 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL9250525 0.90 TSHR (0.57) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL6887082 0.89 TSHR (0.77) TSHRHPGDALDH1A1CYP3A4HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150119510-A1 INKJET INK CONTAINING POLYSTYREN COPOLYMER LATEX SUITABLE FOR INDIRECT PRINTING XEROX CORPORATION (US) 2015-04-30 US claimed
US-7579128-B2 Toner compositions including styrene containing external additives XEROX CORPORATION (US) 2009-08-25 US claimed
US-20080241724-A1 TONER COMPOSITIONS INCLUDING STYRENE CONTAINING EXTERNAL ADDITIVES XEROX CORPORATION (US) 2008-10-02 US claimed
US-7214463-B2 Toner processes XEROX CORPORATION (US) 2007-05-08 US claimed
CN-108153121-B Metal toner comprising metal integrated particles 施乐公司 2023-06-20 CN disclosed
CN-107526256-B Toner compositions with anti-plasticizers 施乐公司 2023-04-07 CN disclosed
CN-115677911-A Organic additives and compositions containing organic additives 施乐公司 2023-02-03 CN disclosed
CN-114265290-A Textile custom printed with antimicrobial nanoparticles 施乐公司 2022-04-01 CN disclosed
CN-113376980-A Titania-free toner additive formulations with crosslinked organic polymer additives 施乐公司 2021-09-10 CN disclosed
CN-113376982-A Toner comprising toner additive formulation 施乐公司 2021-09-10 CN disclosed
EP-3680719-A1 NON-BISPHENOL-A EMULSION AGGREGATION TONER AND PROCESS Xerox Corporation (US) 2020-07-15 EP disclosed
US-10675862-B2 Compositions and use of compositions in printing processes XEROX CORPORATION (US) 2020-06-09 US disclosed
US-20080241724-A1 TONER COMPOSITIONS INCLUDING STYRENE CONTAINING EXTERNAL ADDITIVES XEROX CORPORATION (US) 2008-10-02 US disclosed
EP-1832606-A1 toner composition and methods Xerox Corporation (US) 2007-09-12 EP disclosed
US-20070207400-A1 Toner composition and methods XEROX CORPORATION 2007-09-06 US disclosed
US-20070134576-A1 Toner composition XEROX CORPORATION 2007-06-14 US disclosed
US-20070037086-A1 Toner composition XEROX CORPORATION 2007-02-15 US disclosed
US-20060269858-A1 Toner compositions including styrene containing external additives XEROX CORPORATION (US) 2006-11-30 US disclosed
US-6808851-B2 HIGH PIGMENT LOADING; WAX THAT HAS A MELT DISTRIBUTION SUBSTANTIALLY ABOVE THE COALESCENCE TEMPERATURE OF THE TONER; WAXES ARE MELT HOMOGENIZED; BLEND OF WAXES HAVING DIFFERENT A MOLECULAR WEIGHT BETWEEN 500 AND 2,500. XEROX CORPORATION 2004-10-26 US disclosed
US-20040137357-A1 EMULSION AGGREGATION TONER CONTAINING A MIXTURE OF WAXES INCORPORATING AN IMPROVED PROCESS TO PREVENT WAX PROTRUSIONS AND COARSE PARTICLES XEROX CORPORATION 2004-07-15 US disclosed