SCHEMBL5548596

SCHEMBL5548596

Fc1cccc(Oc2csc(C(F)(F)F)c2)n1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.38
MAPT P10636 1/20 0.35
F10 P00742 1/20 0.33
FPR2 P25090 1/20 0.32
SCN9A Q15858 1/20 0.32
MAPK1 P28482 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
SCHEMBL8121468 0.82 MAPT (0.52) MAPTMAPK1
SCHEMBL8126331 0.79 KDM4E (0.46) MAPTMAPK1
SCHEMBL8111372 0.79 MMP13 (0.37)
SCHEMBL8119862 0.79 MMP13 (0.39) MAPK1
SCHEMBL8126314 0.76 HDAC6 (0.37) MAPT
SCHEMBL8134141 0.75
SCHEMBL22061575 0.75 F2 (0.41) CHRM5F10FPR2SCN9A
SCHEMBL8105403 0.75 POLB (0.31) MAPT
SCHEMBL8126135 0.75 MAPT (0.34) CHRM5MAPTMAPK1
SCHEMBL5548655 0.75 MAPT (0.34) MAPTMAPK1

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-7211673-B2 4-trifluoromethylpyrazolyl-substituted pyridines and pyrimidines BAYER CROPSCIENCE GMBH (DE) 2007-05-01 US disclosed
US-20060122063-A1 5-methyl-2-(4-trifluoromethyl-1H-1-pyrazolyl)-4-(5-trifluoromethyl-3-thienyloxy)pyrimidine; broadleaf herbicide BAYER CROPSCIENCE GMBH (DE) 2006-06-08 US disclosed
US-7022650-B2 4-trifluoromethylpyrazolyl-substituted pyridines and pyrimidines BAYER CROPSCIENCE GMBH (DE) 2006-04-04 US disclosed
EP-1527069-A2 PYRIDINES AND PYRIMIDINES SUBSTITUTED BY 4-TRIFLUOROMETHYLPYRAZOLYL Bayer CropScience GmbH (DE) 2005-05-04 EP disclosed
US-20040072692-A1 4-trifluoromethylpyrazolyl-substituted pyridines and pyrimidines BAYER CROPSCIENCE AG (DE) 2004-04-15 US disclosed
WO-2004013131-A2 PYRIDINES AND PYRIMIDINES SUBSTITUTED BY 4-TRIFLUOROMETHYLPYRAZOLYL BAYER CROPSCIENCE GMBH (DE) 2004-02-12 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 (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-20040072692-A1 4-trifluoromethylpyrazolyl-substituted pyridines and pyrimidines CYP4X1, ROS1, NOX4 CHRM5 826/4885MAPT 3908/4885F10 2463/4885
US-20060122063-A1 5-methyl-2-(4-trifluoromethyl-1H-1-pyrazolyl)-4-(5-trifluoromethyl-3-thienyloxy)pyrimidine; broadleaf herbicide CYP2F1, CYP4F2, CYP4F3 CHRM5 409/4885MAPT 3545/4885F10 2564/4885

“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.