SCHEMBL6481052

SCHEMBL6481052

O=C(O)c1ccc(Cl)c(Cn2ncnn2)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
F10 P00742 1/20 0.36
TSHR P16473 2/20 0.36
MYC P01106 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TP53 P04637 1/20 0.33
CASP1 P29466 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CNR2 P34972 1/20 0.32
BUB1 O43683 1/20 0.32
NOTUM Q6P988 2/20 0.31
RORC P51449 2/20 0.30
NR4A1 P22736 1/20 0.30
CTSB P07858 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL6481972 0.89 POLB (0.40) POLBF10CNR2NOTUM
SCHEMBL6489730 0.84 POLB (0.39) POLBF10TSHRALDH1A1TP53
SCHEMBL6494865 0.82 POLB (0.33) POLBF10MYCCNR2
SCHEMBL6491519 0.80 POLB (0.34) POLBF10SMN1; SMN2
SCHEMBL6491262 0.80 POLB (0.34) POLBF10SMN1; SMN2
SCHEMBL6609162 0.79 POLB (0.33) POLBF10
SCHEMBL6481979 0.78 POLB (0.33) POLBF10
SCHEMBL6493117 0.78 POLB (0.33) POLBF10
SCHEMBL6488316 0.77 POLB (0.34) POLBF10RORC
SCHEMBL6481065 0.76 MYC (0.37) POLBTSHRMYCALDH1A1SMN1; 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-20050090398-A1 Novel tetrazole derivative useful as herbicides YANAGI AKIHIKO (JP) 2005-04-28 US disclosed
EP-1476437-A1 NOVEL TETRAZOLE DERIVATIVE USEFUL AS HERBICIDES Bayer CropScience AG (DE) 2004-11-17 EP disclosed
WO-2003066607-A1 NOVEL TETRAZOLE DERIVATIVE USEFUL AS HERBICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-08-14 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-20050090398-A1 Novel tetrazole derivative useful as herbicides DDT, TTI1, CYP1A1 POLB 3390/4885F10 2051/4885TSHR 17/4885

“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.