SCHEMBL8908298

SCHEMBL8908298

NNc1nc(Cl)nc(Nc2ccc(F)c(C(F)(F)F)c2)n1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.53
APP P05067 6/20 0.51
STK17A Q9UEE5 2/20 0.50
STK17B O94768 1/20 0.50
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
IDO1 P14902 1/20 0.44
CHRNA7 P36544 1/20 0.43
TDO2 P48775 1/20 0.43
TXN P10599 1/20 0.42
GAA P10253 2/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL8908455 0.90 APP (0.54) APPSTK17ASTK17BCA12CA1
SCHEMBL8908512 0.82 STK17A (0.51) HSP90AA1STK17ASTK17BTDO2MAPK1
SCHEMBL12060245 0.82 STK17A (0.46) HSP90AA1STK17ASTK17BIDO1CHRNA7
SCHEMBL12060247 0.81 STK17A (0.52) HSP90AA1APPSTK17ASTK17BIDO1
SCHEMBL8908486 0.80 STK17A (0.50) HSP90AA1STK17ASTK17BIDO1GAA
SCHEMBL8908495 0.77 STK17A (0.49) APPSTK17ASTK17BGAAMAPT
SCHEMBL1391463 0.76 APP (0.46) HSP90AA1APPSTK17ASTK17BCA12
SCHEMBL12142181 0.75 MAPT (0.52) APPSTK17ASTK17BCA12CA1
SCHEMBL12060246 0.75 STK17A (0.44) APPSTK17ASTK17BIDO1CHRNA7
SCHEMBL15338538 0.74 APP (0.49) HSP90AA1APPCA12CA1CA2

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-8188273-B2 Insecticidal (1,3,5)-triazinyl phenyl hydrazones DOW AGROSCIENCES, LLC. (US) 2012-05-29 US disclosed
US-20120040837-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES DOW AGROSCIENCES LLC (US) 2012-02-16 US disclosed
US-8067588-B2 Insecticidal (1,3,5)-triazinyl phenyl hydrazones DOW AGROSCIENCES LLC (US) 2011-11-29 US disclosed
US-20090093481-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES DOW AGROSCIENCES LLC (US) 2009-04-09 US disclosed
US-20090093481-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES DOW AGROSCIENCES LLC (US) 2009-04-09 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-20090093481-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES HELZ, API5, CRYZ HSP90AA1 252/4885APP 2064/4885STK17A 2330/4885
US-20120040837-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES HELZ, API5, CRYZ HSP90AA1 252/4885APP 2064/4885STK17A 2330/4885

“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.