SCHEMBL12747351

SCHEMBL12747351

Cc1ccc(C2=C(OC(=O)C(C)(C)C)C3(CCCCC3)OC2=O)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.34
KDM4E B2RXH2 2/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
TP53 P04637 2/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 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
SCHEMBL12747347 0.91 PTGS2 (0.38) THRBL3MBTL1LMNA
SCHEMBL13299105 0.90 THRB (0.43) THRBLMNAKDM4EHTTATM
SCHEMBL9883925 0.87 POLB (0.38) THRBL3MBTL1LMNAKDM4EHTT
SCHEMBL14432215 0.81 L3MBTL1 (0.34) THRBL3MBTL1LMNATP53POLB
Spirodiclofen SCHEMBL27234 0.81 THRB (0.36) THRBLMNAKDM4EPOLB
Spirodiclofen SCHEMBL29412293 0.81 THRB (0.36) THRBLMNAKDM4EPOLB
SCHEMBL14011105 0.80 PTGS2 (0.38) THRBLMNAHTTTP53POLB
SCHEMBL17111302 0.78 PTGS2 (0.39) THRBLMNA
SCHEMBL31141509 0.77 PTGS2 (0.40) THRBLMNA
SCHEMBL18205707 0.77 PTGS2 (0.40) THRBLMNA

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-20110071220-A1 Use of Tetronic Acid Derivatives for Fighting Insects and Red Spider Mites by Watering on the Ground, Droplet Application or Immersion Application BAYER CROPSCIENCE AG (DE) 2011-03-24 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-20110071220-A1 Use of Tetronic Acid Derivatives for Fighting Insects and Red Spider Mites by Watering on the Ground, Droplet Application or Immersion Application DDT, TYR, GAP43 THRB 166/4885L3MBTL1 1394/4885LMNA 3140/4885

“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.