SCHEMBL4572166

SCHEMBL4572166

COC(=O)CCOc1ncccc1Oc1cc(-n2c(=O)cc(C(F)(F)F)n(C)c2=O)c(F)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 7/20 0.36
CYP3A4 P08684 5/20 0.36
MAPK8 P45983 1/20 0.35
BCAT1 P54687 3/20 0.35
BCAT2 O15382 2/20 0.35
HTR1A P08908 1/20 0.35
DRD2 P14416 1/20 0.35
ADRA1A P35348 1/20 0.35
P2RX3 P56373 2/20 0.33
ROCK2 O75116 1/20 0.33
MET P08581 1/20 0.32
DHODH Q02127 1/20 0.32
P2RY1 P47900 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
SCHEMBL3825548 0.92 MAPK8 (0.35) UGCGCYP3A4MAPK8BCAT1BCAT2
SCHEMBL22912498 0.91 MAPK8 (0.35) UGCGCYP3A4MAPK8BCAT1BCAT2
SCHEMBL22912499 0.90 ROCK2 (0.34) UGCGCYP3A4MAPK8BCAT1BCAT2
SCHEMBL4572164 0.90 BCAT1 (0.38) BCAT1BCAT2METDHODH
SCHEMBL6637334 0.89 PPOX (0.34) UGCGCYP3A4MAPK8BCAT1BCAT2
SCHEMBL26113051 0.88 BCAT1 (0.34) UGCGCYP3A4MAPK8BCAT1BCAT2
SCHEMBL6639709 0.88 MAPK8 (0.35) UGCGCYP3A4MAPK8BCAT1BCAT2
SCHEMBL2594502 0.88 BCAT1 (0.41) UGCGCYP3A4MAPK8BCAT1BCAT2
Benzene SCHEMBL21843346 0.87 BCAT1 (0.34) UGCGCYP3A4MAPK8BCAT1BCAT2
SCHEMBL29709277 0.87 BCAT1 (0.34) UGCGCYP3A4MAPK8BCAT1BCAT2

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-8293979-B2 Weed controller metabolism proteins, genes, thereof and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-23 US disclosed
EP-2453018-A1 A herbicide metabolizing protein, a gene thereof and use thereof Sumitomo Chemical Company, Limited (JP) 2012-05-16 EP disclosed
US-20100313300-A1 WEED CONTROLLER METABOLISM PROTEINS, GENES, THEREOF AND USE OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED 2010-12-09 US disclosed
US-7745699-B2 Weed controller metabolism proteins, genes thereof and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-29 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-20100313300-A1 WEED CONTROLLER METABOLISM PROTEINS, GENES, THEREOF AND USE OF THE SAME HADHB, WEE1, AS3MT UGCG 2447/4885CYP3A4 367/4885MAPK8 3836/4885

“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.