SCHEMBL2841440

SCHEMBL2841440

COC(=CC(=O)O)COc1cc(-n2c(=O)cc(C(F)(F)F)[nH]c2=O)c(F)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BCAT1 P54687 19/20 0.51
BCAT2 O15382 17/20 0.51
PPOX P50336 1/20 0.37

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
SCHEMBL2841434 1.00 BCAT1 (0.51) BCAT1BCAT2PPOX
SCHEMBL2841437 1.00 BCAT1 (0.51) BCAT1BCAT2PPOX
SCHEMBL2832656 0.93 BCAT1 (0.53) BCAT1BCAT2
SCHEMBL2832659 0.93 BCAT1 (0.53) BCAT1BCAT2
SCHEMBL2832658 0.93 BCAT1 (0.53) BCAT1BCAT2
SCHEMBL1574611 0.92 BCAT1 (0.50) BCAT1BCAT2
SCHEMBL1574612 0.92 BCAT1 (0.50) BCAT1BCAT2
SCHEMBL1574614 0.92 BCAT1 (0.50) BCAT1BCAT2
SCHEMBL2833155 0.92 BCAT1 (0.50) BCAT1BCAT2PPOX
SCHEMBL2834905 0.91 BCAT1 (0.47) BCAT1BCAT2PPOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7754880-B2 Uracils having a herbicidal activity ISAGRO RICERCA S.R.L. (IT) 2010-07-13 US claimed
US-20060025591-A1 New uracils having a herbicidal activity ISEM S.R.L. (IT) 2006-02-02 US claimed
US-7754880-B2 Uracils having a herbicidal activity ISAGRO RICERCA S.R.L. (IT) 2010-07-13 US disclosed
US-20060025591-A1 New uracils having a herbicidal activity ISEM S.R.L. (IT) 2006-02-02 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-20060025591-A1 New uracils having a herbicidal activity UNG, DDT, UMPS BCAT1 762/4885BCAT2 770/4885PPOX 2168/4885

“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.