SCHEMBL236032

SCHEMBL236032

CN1COCN(CC2CCOC2)C1=N[N+](=O)[O-]

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
CYP11B2 P19099 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
SCHEMBL9059259 1.00 CNR1 (0.31) CNR1CNR2CYP11B2
SCHEMBL6186039 0.84 CYP11B2 (0.30) CYP11B2
SCHEMBL8546024 0.84 CYP11B2 (0.30) CYP11B2
SCHEMBL10026157 0.84 CYP11B2 (0.30) CYP11B2
SCHEMBL10082134 0.83 CNR1 (0.33) CNR1CNR2CYP11B2
SCHEMBL6189245 0.81
SCHEMBL6187672 0.80
SCHEMBL6189326 0.78 HSD11B1 (0.36)
SCHEMBL9063102 0.76 CYP11B2 (0.32) CYP11B2
SCHEMBL9059438 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8291171-A None JP disclosed
EP-2225940-B1 Oil dispersions of nAChR binding neonicotinoids GAT MICROENCAPSULATION GMBH (AT) 2014-03-12 EP disclosed
EP-2225940-B1 Oil dispersions of nAChR binding neonicotinoids GAT MICROENCAPSULATION GMBH (AT) 2014-03-12 EP disclosed
US-8293733-B2 Oil dispersions of nAChR binding neonicotinoids GAT MICROENCAPSULATION AG (AT) 2012-10-23 US disclosed
US-8293733-B2 Oil dispersions of nAChR binding neonicotinoids GAT MICROENCAPSULATION AG (AT) 2012-10-23 US disclosed
US-20120004104-A1 OIL DISPERSIONS OF nAChR BINDING NEONICOTINOIDS GAT MICROENCAPSULATION AG (AT) 2012-01-05 US disclosed
US-20120004104-A1 OIL DISPERSIONS OF nAChR BINDING NEONICOTINOIDS GAT MICROENCAPSULATION AG (AT) 2012-01-05 US disclosed
WO-2010099965-A2 OIL DISPERSIONS OF NACHR BINDING NEONICOTINOIDS GAT MICROENCAPSULATION AG (AT) 2010-09-10 WO disclosed
EP-2225940-A1 Oil dispersions of nAChR binding neonicotinoids GAT Microencapsulation AG (AT) 2010-09-08 EP disclosed
JP-H08291171-A INSECTICIDAL 5-((TETRAHYDRO-3-FURANYL)METHYL)-4-NITROIMINOPERPHYDRO-1,3,5-OXADIAZINE DERIVATIVE MITSUI TOATSU CHEM INC 1996-11-05 JP 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-20120004104-A1 OIL DISPERSIONS OF nAChR BINDING NEONICOTINOIDS CHRND, ITGAM, CHRM2 CNR1 469/4885CNR2 372/4885CYP11B2 3131/4885

“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.