SCHEMBL6237813

SCHEMBL6237813

COc1ccc(Oc2cc(-n3c(=O)cc(C(F)(F)F)[nH]c3=O)c(F)cc2C#N)cc1

nearest known ligand 0.82

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 20/20 0.82
BCAT2 O15382 17/20 0.82

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
SCHEMBL7653665 0.89 BCAT1 (0.72) BCAT1BCAT2
SCHEMBL6700098 0.87 BCAT1 (0.82) BCAT1BCAT2
SCHEMBL6696068 0.85 BCAT1 (0.73) BCAT1BCAT2
SCHEMBL29779261 0.84 BCAT1 (1.00) BCAT1BCAT2
SCHEMBL29779361 0.84 BCAT1 (0.84) BCAT1BCAT2
SCHEMBL24825974 0.84 BCAT1 (1.00) BCAT1BCAT2
SCHEMBL24825580 0.84 BCAT1 (0.84) BCAT1BCAT2
SCHEMBL24824016 0.83 BCAT1 (1.00) BCAT1BCAT2
SCHEMBL24823997 0.83 BCAT1 (1.00) BCAT1BCAT2
SCHEMBL29779240 0.83 BCAT1 (1.00) BCAT1BCAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1095027-B1 SUBSTITUTED PHENYL URACILS BAYER CROPSCIENCE AG (DE) 2005-06-15 EP disclosed
US-20040254206-A1 Substituted phenyluracils ANDREE ROLAND (DE) 2004-12-16 US disclosed
US-6815398-B1 PRE- AND POSTEMERGENCE HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2004-11-09 US disclosed
US-6780821-B1 HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2004-08-24 US disclosed
EP-1242387-A1 SUBSTITUTED PHENYLURACILS AND THEIR USE AS HERBICIDES Bayer Aktiengesellschaft (DE) 2002-09-25 EP disclosed
WO-2001034575-A1 SUBSTITUTED PHENYLURACILS AND THEIR USE AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-05-17 WO disclosed
EP-1095027-A1 SUBSTITUTED PHENYL URACILS BAYER AG (DE) 2001-05-02 EP disclosed
WO-2000002866-A1 SUBSTITUTED PHENYL URACILS BAYER AKTIENGESELLSCHAFT (DE) 2000-01-20 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-20040254206-A1 Substituted phenyluracils DPYD, NDUFS5, POP1 BCAT1 819/4885BCAT2 664/4885

“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.