SCHEMBL7759129

SCHEMBL7759129

C=C(C)C(=O)OCOC(=O)CC(=O)OCOC(=O)C(=C)C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
TSHR P16473 5/20 0.52
THRB P10828 1/20 0.48
MGAM O43451 2/20 0.46
GAA P10253 2/20 0.46
SI P14410 2/20 0.46
MGAM2 Q2M2H8 2/20 0.46
TDP1 Q9NUW8 3/20 0.35
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
HSD17B10 Q99714 2/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL5697565 0.93 TSHR (0.47) ALDH1A1TSHRTHRBMGAMGAA
SCHEMBL148579 0.92 TSHR (0.58) ALDH1A1TSHRTHRBMGAMGAA
Hydrochloric Acid SCHEMBL14976774 0.90 TSHR (0.56) ALDH1A1TSHRTHRBMGAMGAA
SCHEMBL93563 0.88 TSHR (0.50) ALDH1A1TSHRTHRBMGAMGAA
SCHEMBL12255537 0.86 TSHR (0.65) ALDH1A1TSHRTHRBMGAMGAA
SCHEMBL2609254 0.86 THRB (0.50) ALDH1A1TSHRTHRBMGAMGAA
SCHEMBL8452794 0.85 TSHR (0.52) ALDH1A1TSHRTHRBTDP1POLB
SCHEMBL2625617 0.85 TSHR (0.52) ALDH1A1TSHRTHRBGAATDP1
SCHEMBL8452792 0.85 TSHR (0.52) ALDH1A1TSHRTHRBTDP1POLB
Ethylene Glycol SCHEMBL148578 0.85 TSHR (0.52) ALDH1A1TSHRTHRBTDP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090009061-A1 Composition for Conductive Materials Comprising Crosslinkable Arylamine Compounds and Use Thereof in Electronic Devices and Electronic Equipment SEIKO EPSON CORPORATION (JP) 2009-01-08 US disclosed
EP-0756208-B1 Resin composition for electrophotographic toner, and toner comprising it MITSUI CHEMICALS INC (JP) 2001-04-11 EP disclosed
US-6011119-A RESIN COMPOSITION SHOWS EXCELLENT CHARGING CHARACTERISTICS WITHOUT A CHARGE CONTROL AGENT; HIGH AND LOW MOLECULAR WEIGHT ADDITION POLYMERS AT LEAST ONE OF WHICH IS FROM AN UNSATURATED ANHYDRIDE AND AN ACRYLOYLOXYALKYL DICARBOXYLIC ACID ESTER MITSUI CHEMICALS, INC. (JP) 2000-01-04 US disclosed
EP-0756208-A1 Resin composition for electrophotographic toner, and toner comprising it MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-29 EP 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 (1 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-20090009061-A1 Composition for Conductive Materials Comprising Crosslinkable Arylamine Compounds and Use Thereof in Electronic Devices and Electronic Equipment AHR, SLC43A1, SLC1A2 ALDH1A1 1236/4885TSHR 3348/4885THRB 3009/4885

“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.