SCHEMBL12430766

SCHEMBL12430766

Cn1c(C(F)(F)F)cc(=O)n(-c2cc(Oc3cccnc3CO)c(Cl)cc2F)c1=O

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 8/20 0.37
BCAT2 O15382 6/20 0.37
DHODH Q02127 7/20 0.35
MAT2A P31153 1/20 0.31
CYP3A4 P08684 1/20 0.31
UGCG Q16739 1/20 0.31
SCN9A Q15858 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
SCHEMBL13064462 0.93 BCAT1 (0.35) BCAT1BCAT2DHODHMAT2ACYP3A4
SCHEMBL10086757 0.92 BCAT1 (0.37) BCAT1BCAT2MAT2A
SCHEMBL13397269 0.89 GPBAR1 (0.35) BCAT1BCAT2DHODH
SCHEMBL2736477 0.88 BCAT1 (0.38) BCAT1BCAT2DHODHMAT2ASCN9A
SCHEMBL2594502 0.88 BCAT1 (0.41) BCAT1BCAT2DHODHMAT2ACYP3A4
SCHEMBL4736723 0.88 BCAT1 (0.39) BCAT1BCAT2DHODHMAT2A
SCHEMBL21615919 0.88 BCAT1 (0.39) BCAT1BCAT2DHODHMAT2A
SCHEMBL130065 0.87 BCAT1 (0.39) BCAT1BCAT2MAT2ACYP3A4
SCHEMBL20334530 0.86 BCAT1 (0.36) BCAT1BCAT2MAT2ACYP3A4UGCG
SCHEMBL6635645 0.85 BCAT1 (0.35) BCAT1BCAT2DHODHMAT2ACYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853496-B2 Plants tolerant to HPPD inhibitor herbicides BAYER CROPSCIENCE AG (DE) 2014-10-07 US disclosed
US-20110191897-A1 Plants Tolerant to HPPD Inhibitor Herbicides BAYER CROPSCIENCE AG (DE) 2011-08-04 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-20110191897-A1 Plants Tolerant to HPPD Inhibitor Herbicides HPD, DDT, PHPT1 BCAT1 391/4885BCAT2 664/4885DHODH 51/4885

“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.