SCHEMBL3761246

SCHEMBL3761246

CC(C)c1cc[n+]([O-])c(SCc2c(C(F)(F)F)nn(C)c2OCC(F)(F)F)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL3759353 0.87 MEN1 (0.34) MEN1KMT2ASMN1; SMN2
SCHEMBL3760732 0.79 ALDH1A1 (0.31)
SCHEMBL3757052 0.71 LMNA (0.39) MEN1KMT2ASMN1; SMN2
SCHEMBL4161956 0.71 MPO (0.31) MEN1KMT2ASMN1; SMN2
SCHEMBL3761450 0.69 ALDH1A1 (0.34)
SCHEMBL1027343 0.68 MPO (0.33) MEN1KMT2ASMN1; SMN2
SCHEMBL4555717 0.68 NPSR1 (0.34) SMN1; SMN2
SCHEMBL4164764 0.67 MEN1 (0.31) MEN1KMT2ASMN1; SMN2
SCHEMBL4171348 0.67 L3MBTL1 (0.32) MEN1KMT2ASMN1; SMN2
SCHEMBL3754415 0.66 MEN1 (0.33) MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298141-A1 SUBSTITUTED PYRIDINE N-OXIDE HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-11-25 US disclosed
EP-2120939-A2 SUBSTITUTED PYRIDINE N-OXIDE HERBICIDES E. I. Du Pont de Nemours and Company (US) 2009-11-25 EP disclosed
WO-2008100426-A2 SUBSTITUTED PYRIDINE N-OXIDE HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-08-21 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 (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-20100298141-A1 SUBSTITUTED PYRIDINE N-OXIDE HERBICIDES CYP3A7, CYP2W1, CBR3 MEN1 3920/4885KMT2A 3291/4885SMN1; SMN2 3285/4885

“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.