SCHEMBL6482840

SCHEMBL6482840

O=C1CCCCC(Cl)=C1C(=O)c1ccc(Cl)c(Cn2cnnn2)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.34
ALDH1A1 P00352 1/20 0.34
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ATM Q13315 1/20 0.31
RCE1 Q9Y256 1/20 0.31
F10 P00742 1/20 0.31
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
KMT2A Q03164 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
SCHEMBL6494841 0.98 MAPK1 (0.34) MAPK1ALDH1A1KDM4EL3MBTL1F10
SCHEMBL6480815 0.84
SCHEMBL6493117 0.81 POLB (0.33) F10
SCHEMBL6495071 0.81 MAPK1 (0.35) MAPK1ALDH1A1KDM4EL3MBTL1ATM
SCHEMBL6481403 0.80 MAPK1 (0.35) MAPK1
SCHEMBL6481979 0.79 POLB (0.33) F10
SCHEMBL6480971 0.78 MAPK1 (0.35) MAPK1ALDH1A1ATMRCE1F10
SCHEMBL6492717 0.78 MAPK1 (0.41) MAPK1ALDH1A1KDM4EL3MBTL1F10
SCHEMBL6481316 0.78 MAPK1 (0.41) MAPK1ALDH1A1KDM4EL3MBTL1F10
SCHEMBL6482302 0.74 MAPK1 (0.33) MAPK1ALDH1A1KDM4EATMRCE1

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 1 patent. 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

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 MAPK1 2914/4885ALDH1A1 533/4885KDM4E 2902/4885

“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.