SCHEMBL3717495

SCHEMBL3717495

C=CCC(Oc1ccccc1)C1=NCCN1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ADRA2B P18089 13/20 0.57
▸ ADRA2C P18825 13/20 0.57
▸ ADRA2A P08913 12/20 0.57
▸ MAOA P21397 11/20 0.57
▸ MAOB P27338 11/20 0.57
▸ NISCH Q9Y2I1 7/20 0.57
▸ HTR1A P08908 2/20 0.49
▸ KCNH2 Q12809 1/20 0.49

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
SCHEMBL11246125 0.78 ADRA2B (0.61) ADRA2BADRA2CADRA2AMAOAMAOB
SCHEMBL545845 0.77 NISCH (0.50) ADRA2BADRA2CADRA2AMAOAMAOB
SCHEMBL17887783 0.76 ADRA2A (0.58) ADRA2BADRA2CADRA2AMAOAMAOB
SCHEMBL2778291 0.73 ADRA2A (0.67) ADRA2BADRA2CADRA2AMAOAMAOB
SCHEMBL17887853 0.73 ADRA2A (1.00) ADRA2BADRA2CADRA2AMAOAMAOB
SCHEMBL27816063 0.72 SLC6A4 (0.50) KCNH2
SCHEMBL3065600 0.71 ADRA2B (0.48) ADRA2BADRA2CADRA2ANISCHHTR1A
SCHEMBL1778182 0.66 CYP2C19 (0.41) —
SCHEMBL8943022 0.66 TSHR (0.37) —
SCHEMBL11035887 0.65 ADRA2B (0.39) ADRA2BADRA2CADRA2AMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455663-B2 Halosubstituted aryloxyalkylimidazolines for use as pesticides SYNGENTA CROP PROTECTION LLC (US) 2013-06-04 — — US disclosed
EP-2190823-B1 Halosubstituted aryloxyalkylimidazolines for use as pesticides SYNGENTA PARTICIPATIONS AG (CH) 2012-07-11 — — EP disclosed
US-20100280088-A1 HALOSUBSTITUTED ARYLOXYALKYLIMIDAZOLINES FOR USE AS PESTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — US disclosed
EP-2190823-A1 HALOSUBSTITUTED ARYLOXYALKYLIMIDAZOLINES FOR USE AS PESTICIDES Syngenta Participations AG (CH) 2010-06-02 — — EP disclosed
WO-2009036908-A1 HALOSUBSTITUTED ARYLOXYALKYLIMIDAZOLINES FOR USE AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-03-26 — — WO disclosed
WO-2009036909-A1 HALOSUBSTITUTED ARYLOXYALKYLIMIDAZOLINES FOR USE AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-03-26 — — 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 (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-20100280088-A1 HALOSUBSTITUTED ARYLOXYALKYLIMIDAZOLINES FOR USE AS PESTICIDES GLRA3, GLRX3, GLRA1 ADRA2B 299/4885ADRA2C 202/4885ADRA2A 265/4885

“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.

Send feedback