SCHEMBL1011627

SCHEMBL1011627

CCCCN1CN(N)C=N1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
TLR8 Q9NR97 2/20 0.31
ADORA2A P29274 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
SCHEMBL28252922 0.98 GNAI3 (0.32) GNAI3GNAO1GNAI1TLR8
Bromide SCHEMBL28223416 0.98 GNAI3 (0.32) GNAI3GNAO1GNAI1TLR8
SCHEMBL1010403 0.94 GNAI3 (0.40) GNAI3GNAO1GNAI1TLR8
SCHEMBL1010402 0.88
SCHEMBL16667540 0.78 TBXAS1 (0.33) GNAI3GNAO1GNAI1TLR8
SCHEMBL23913538 0.66
Methylamine SCHEMBL27909059 0.64 ADORA2A (0.30) ADORA2A
SCHEMBL7026105 0.63
SCHEMBL28224016 0.62 ADORA2A (0.33) ADORA2A
SCHEMBL90273 0.61 GNAI3 (0.34) GNAI3GNAO1GNAI1TLR8

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
CN-117525577-A Electrolyte capable of improving cycle performance of hard carbon negative electrode of sodium battery 刘德敏 2024-02-06 CN claimed
CN-108774184-A A kind of four cyanogen of 1- butyl -4- amino -1,2,4- triazoles conjunction copper ionic liquid containing energy and preparation method 西北工业大学 2018-11-09 CN claimed
CN-108314598-A It is a kind of that iron is closed as anion ionic liquid containing energy and preparation method using six cyanogen of transient metal complex 西北工业大学 2018-07-24 CN claimed
CN-108276349-A It is a kind of that cobalt is closed as anion ionic liquid containing energy and preparation method using six cyanogen of transient metal complex 西北工业大学 2018-07-13 CN claimed
CN-108218801-A It is a kind of to contain energy ionic liquid and preparation method using transient metal complex hexanitro cobalt as anion 西北工业大学 2018-06-29 CN claimed
CN-108191780-A It is a kind of that preparation method of the cobalt as the ionic liquid containing energy of anion is closed using four different sulphur cyanogen of transient metal complex 西北工业大学 2018-06-22 CN claimed
EP-1960345-B1 ALKYLATION OF N' -PHENYL-N-ALKYLPHENYLENEDIAMINES IN IONIC LIQUID, AND N' -PHENYL-N-ALKYL(ALKYLPHENYLENE) DIAMINES PRODUCED THEREBY CHEMTURA CORP (US) 2014-11-19 EP claimed
EP-1963253-B1 RING ALKYLATION OF ANILINE OR AN ANILINE DERIVATIVE USING IONIC LIQUID CATALYSTS CHEMTURA CORP (US) 2011-01-05 EP claimed
EP-1960344-B1 ALKYLATION OF A DIPHENYLAMINE COMPOUND IN IONIC LIQUID CHEMTURA CORP (US) 2010-09-29 EP claimed
US-7563929-B2 Alkylation of N′-phenyl-N-alkylphenylenediamines in ionic liquid and N′-phenyl-N-alkyl(alkylphenylene) diamines produced thereby CHEMTURA CORPORATION (US) 2009-07-21 US claimed
CN-101336225-A Alkylation of n' -phenyl-n-alkylphenylenediamines in ionic liquid, n' -phenyl-n-alkyl(alkylphenylene) diamines produced thereby, and lubricant compositions containing same CHEMTURA CORP (US) 2008-12-31 CN claimed
CN-101336223-A Alkylation of a diphenylamine compound in ionic liquid CHEMTURA CORP (US) 2008-12-31 CN claimed
CN-101336224-A Ring alkylation of aniline or an aniline derivative using ionic liquid catalysts CHEMTURA CORP (US) 2008-12-31 CN claimed
US-20080234517-A1 ALKYLATION OF N'-PHENYL-N-ALKYLPHENYLENEDIAMINES IN IONIC LIQUID AND N'-PHENYL-N-ALKYL(ALKYLPHENYLENE) DIAMINES PRODUCED THEREBY CHEMTURA CORPORATION (US) 2008-09-25 US claimed
US-7378554-B2 Ring alkylation of aniline or an aniline derivative using ionic liquid catalysts CHEMTURA CORPORATION (US) 2008-05-27 US claimed
US-20070135657-A1 Alkylation of N'-phenyl-N-alkylphenylenediamines in ionic liquid, N'-phenyl-N-alkyl (alkylphenylene) diamines produced thereby, and lubricant compositions containing same LANXESS SOLUTIONS US INC. 2007-06-14 US claimed
US-20070135656-A1 Ring alkylation of aniline or an aniline derivative using ionic liquid catalysts LANXESS SOLUTIONS US INC. 2007-06-14 US claimed
US-7145038-B1 Alkylation of a diphenylamine compound in ionic liquid CHEMTURA CORPORATION (US) 2006-12-05 US claimed
CN-117525577-A Electrolyte capable of improving cycle performance of hard carbon negative electrode of sodium battery 刘德敏 2024-02-06 CN disclosed
US-7145038-B1 Alkylation of a diphenylamine compound in ionic liquid CHEMTURA CORPORATION (US) 2006-12-05 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 (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-20080234517-A1 ALKYLATION OF N'-PHENYL-N-ALKYLPHENYLENEDIAMINES IN IONIC LIQUID AND N'-PHENYL-N-ALKYL(ALKYLPHENYLENE) DIAMINES PRODUCED THEREBY PNMT, PNN, INMT GNAI3 1554/4885GNAO1 1486/4885GNAI1 1259/4885
US-20070135657-A1 Alkylation of N'-phenyl-N-alkylphenylenediamines in ionic liquid, N'-phenyl-N-alkyl (alkylphenylene) diamines produced thereby, and lubricant compositions containing same NAPEPLD, PNN, ACR GNAI3 2663/4885GNAO1 2329/4885GNAI1 1905/4885

“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.