SCHEMBL4516642

SCHEMBL4516642

CCCC[N+]1=C(C)N(C)CC1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EEF2K O00418 1/20 0.38

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
Iodide SCHEMBL18420850 0.98 EEF2K (0.40) EEF2K
SCHEMBL1831895 0.88 EEF2K (0.33) EEF2K
SCHEMBL7776941 0.74 EEF2K (0.61) EEF2K
Hydrochloric Acid SCHEMBL7775450 0.73 EEF2K (0.59) EEF2K
Hydrochloric Acid SCHEMBL11786436 0.73 EEF2K (0.59) EEF2K
Hydrochloric Acid SCHEMBL11783365 0.69 EEF2K (0.51) EEF2K
SCHEMBL7773581 0.68 EEF2K (0.38) EEF2K
SCHEMBL17765553 0.68 EEF2K (0.38) EEF2K
Hydrochloric Acid SCHEMBL11782306 0.67 EEF2K (0.35) EEF2K
SCHEMBL21049595 0.67 L3MBTL1 (0.31) EEF2K

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036718-A1 USE OF A COMPOSITION OF AN IONIC NATURE AS A SUBSTITUTION REAGENT, A COMPOSITION CONSTITUTING A FLUORINATION REAGENT AND A METHOD USING SAME RHODIA CHIMIE (FR) 2009-02-05 US disclosed
US-7393980-B2 Use of a composition of an ionic nature as a substrate reagent, a composition constituting a fluorination reagent and a method using same RHODIA CHIMIE (FR) 2008-07-01 US disclosed
US-20040144947-A1 Use of a composition of an ionic nature as a substrate reagent, a composition constituting a fluorination reagent and a method using same RHODIA CHIMIE (FR) 2004-07-29 US disclosed
EP-1401844-A2 USE OF A COMPOSITION OF AN IONIC NATURE AS A SUBSTRATE REAGENT, A COMPOSITION CONSTITUTING A FLUORINATION REAGENT AND A METHOD USING SAME RHODIA CHIMIE (FR) 2004-03-31 EP disclosed
WO-2002092608-A2 USE OF A COMPOSITION OF AN IONIC NATURE AS A SUBSTRATE REAGENT, A COMPOSITION CONSTITUTING A FLUORINATION REAGENT AND A METHOD USING SAME RHODIA CHIMIE (FR) 2002-11-21 WO 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 (2 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-20040144947-A1 Use of a composition of an ionic nature as a substrate reagent, a composition constituting a fluorination reagent and a method using same INF2, SNW1, AFF2 EEF2K 1845/4885
US-20090036718-A1 USE OF A COMPOSITION OF AN IONIC NATURE AS A SUBSTITUTION REAGENT, A COMPOSITION CONSTITUTING A FLUORINATION REAGENT AND A METHOD USING SAME H1-10, H1-3, H1-0 EEF2K 2854/4885

“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.