SCHEMBL6683544

SCHEMBL6683544

COc1c(N)c(Cl)cc(F)c1-n1c(=O)cc(C(F)(F)F)n(C)c1=S

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.31
BCAT1 P54687 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
SCHEMBL7657861 0.89 BCAT2 (0.32) BCAT2BCAT1
SCHEMBL6681352 0.84
SCHEMBL6678212 0.83 GRIN2D (0.33)
SCHEMBL5391301 0.80 BCAT2 (0.32) BCAT2BCAT1
SCHEMBL7665375 0.76 BCAT1 (0.55) BCAT2BCAT1
SCHEMBL7668209 0.76 BCAT2 (0.32) BCAT2BCAT1
SCHEMBL7661919 0.76
SCHEMBL5386147 0.73 BCAT2 (0.32) BCAT2BCAT1
SCHEMBL6682441 0.73
SCHEMBL6970724 0.73 COMT (0.30)

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-20040018941-A1 Fused-benzene derivatives of thiouracil, herbicidal and desiccant compositions contaning them ISHIHARA SANGYO KAISHA, LTD. 2004-01-29 US disclosed
WO-2004008859-A1 FUSED-BENZENE DERIVATIVES OF THIOURACIL, HERBICIDAL AND DESICCANT COMPOSITIONS CONTANING THEM ISHIHARA SANGYO KAISHA, LTD. (JP) 2004-01-29 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-20040018941-A1 Fused-benzene derivatives of thiouracil, herbicidal and desiccant compositions contaning them DDT, DPYD, TST BCAT2 542/4885BCAT1 1215/4885

“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.