SCHEMBL838656

SCHEMBL838656

C=CC(=O)OCCOC(=O)CCCCCC

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.72
TSHR P16473 5/20 0.65
HPGD P15428 1/20 0.65
DNM1 Q05193 1/20 0.56
ALDH1A1 P00352 4/20 0.55
CYP3A4 P08684 1/20 0.55
MAPT P10636 1/20 0.53
PAM P19021 2/20 0.51
TP53 P04637 2/20 0.50
HIF1A Q16665 2/20 0.50
HSD17B10 Q99714 1/20 0.50
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
LMNA P02545 2/20 0.47
NAAA Q02083 1/20 0.47
KDM4E B2RXH2 1/20 0.46
DUSP3 P51452 1/20 0.46
THRB P10828 1/20 0.46
MEN1 O00255 1/20 0.46

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
SCHEMBL10426039 1.00 DGKA (0.72) DGKATSHRHPGDDNM1ALDH1A1
SCHEMBL8024637 1.00 DGKA (0.72) DGKATSHRHPGDDNM1ALDH1A1
SCHEMBL9570462 1.00 DGKA (0.72) DGKATSHRHPGDDNM1ALDH1A1
SCHEMBL6469329 0.98 DGKA (0.69) DGKATSHRHPGDDNM1ALDH1A1
SCHEMBL10030735 0.97 DGKA (0.68) DGKATSHRHPGDDNM1ALDH1A1
Propene SCHEMBL19717884 0.97 DGKA (0.68) DGKATSHRHPGDDNM1ALDH1A1
SCHEMBL23553096 0.95 DGKA (0.66) DGKATSHRHPGDDNM1ALDH1A1
SCHEMBL14792967 0.95 DGKA (0.66) DGKATSHRHPGDDNM1ALDH1A1
SCHEMBL10426125 0.95 TSHR (0.68) DGKATSHRHPGDDNM1ALDH1A1
SCHEMBL2610338 0.93 TSHR (0.69) DGKATSHRHPGDDNM1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8653153-B1 Violet curable ink XEROX CORPORATION (US) 2014-02-18 US disclosed
US-8142557-B2 Radiation curable ink containing gellant and radiation curable wax XEROX CORPORATION (US) 2012-03-27 US disclosed
US-7887176-B2 High image quality in inkjet printing onto flexible packaging substrates of polyester, polypropylene, and aluminum foil, can be significantly improved by the use of radiation curable gel based phase change inks; not requiring pinning of the ink during color printing or nitrogen inerting during curing XEROX CORPORATION (US) 2011-02-15 US disclosed
US-20100242790-A1 CATIONICALLY AND HYBRID CURABLE UV GELS XEROX CORPORATION (US) 2010-09-30 US disclosed
US-7714040-B2 Phase change inks containing curable amide gellant compounds XEROX CORPORATION (US) 2010-05-11 US disclosed
US-7531582-B2 Radiation curable phase change inks containing curable epoxy-polyamide composite gellants XEROX CORPORATION (US) 2009-05-12 US disclosed
US-20080122914-A1 RADIATION CURABLE PHASE CHANGE INKS CONTAINING CURABLE EPOXY-POLYAMIDE COMPOSITE GELLANTS XEROX CORPORATION (US) 2008-05-29 US disclosed
US-20080000384-A1 RADIATION CURABLE INK CONTAINING GELLANT AND RADIATION CURABLE WAX XEROX CORPORATION (US) 2008-01-03 US disclosed
US-7279587-B2 Photoinitiator with phase change properties and gellant affinity XEROX CORPORATION (US) 2007-10-09 US disclosed
US-7276614-B2 Curable amide gellant compounds XEROX CORPORATION (US) 2007-10-02 US disclosed
US-7271284-B2 Process for making curable amide gellant compounds XEROX CORPORATION (US) 2007-09-18 US disclosed
US-7259275-B2 Method for preparing curable amide gellant compounds XEROX CORPORATION (US) 2007-08-21 US disclosed
US-20070123606-A1 Phase change inks containing curable amide gellant compounds XEROX CORPORATION 2007-05-31 US disclosed
US-20070123723-A1 Photoinitiator with phase change properties and gellant affinity XEROX CORPORATION 2007-05-31 US disclosed
US-20070123724-A1 Method for preparing curable amide gellant compounds XEROX CORPORATION 2007-05-31 US disclosed
US-20070123663-A1 Process for making curable amide gellant compounds XEROX CORPORATION 2007-05-31 US disclosed
US-20070123722-A1 Ester-terminated oligoamides and polyamides having terminal ethylenic double bonds; gelling agents for phase change ink jet inks with improved ultraviolet curability and solubility XEROX CORPORATION 2007-05-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070123724-A1 Method for preparing curable amide gellant compounds ODC1, INO80C, AOC1 DGKA 1213/4885TSHR 2143/4885HPGD 611/4885
US-20070123723-A1 Photoinitiator with phase change properties and gellant affinity NR2E3, NR4A1, NR4A3 DGKA 3288/4885TSHR 288/4885HPGD 3228/4885
US-20070123722-A1 Ester-terminated oligoamides and polyamides having terminal ethylenic double bonds; gelling agents for phase change ink jet inks with improved ultraviolet curability and solubility CCNA2, ELL, CCNA1 DGKA 3286/4885TSHR 3048/4885HPGD 4535/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.