SCHEMBL6489367

SCHEMBL6489367

O=C1C=C(OC(=O)c2ccc(Br)c(Cn3cnnn3)c2Br)CCC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL6482302 0.83 MAPK1 (0.33) MEN1CYP1A2CYP2C9KMT2ALMNA
SCHEMBL6490299 0.82 TP53 (0.33) LMNATP53
SCHEMBL6495035 0.82
SCHEMBL6493030 0.81 TP53 (0.43) MEN1CYP1A2CYP2C9KMT2ALMNA
SCHEMBL6491567 0.78 MEN1 (0.30) MEN1CYP1A2CYP2C9KMT2A
SCHEMBL6481232 0.76 HMOX1 (0.38) MEN1CYP1A2CYP2C9KMT2ATP53
SCHEMBL6481108 0.75 MAPK1 (0.36) MEN1KMT2ALMNATP53
SCHEMBL6483369 0.75 ALDH1A1 (0.38) MEN1CYP1A2CYP2C9KMT2ALMNA
SCHEMBL6480901 0.72 MAPK1 (0.35) MEN1KMT2ALMNATP53
SCHEMBL6480767 0.71 MAPK1 (0.34) LMNATP53

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 MEN1 2766/4885CYP1A2 47/4885CYP2C9 29/4885

“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.