SCHEMBL6639709

SCHEMBL6639709

COC(=O)COc1cccnc1Oc1cc(-n2c(=O)cc(C(F)(F)F)n(C)c2=O)c(F)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.35
LMNA P02545 2/20 0.35
UGCG Q16739 5/20 0.34
CYP3A4 P08684 4/20 0.34
PPOX P50336 1/20 0.34
BCAT2 O15382 2/20 0.33
BCAT1 P54687 2/20 0.33
DHODH Q02127 3/20 0.33
P2RY1 P47900 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.33
KCNN4 O15554 1/20 0.33
DGAT2 Q96PD7 1/20 0.32
ROCK2 O75116 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 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 0.94 MAPK8 (0.35) MAPK8LMNAUGCGCYP3A4PPOX
SCHEMBL6637334 0.92 PPOX (0.34) MAPK8LMNAUGCGCYP3A4PPOX
SCHEMBL3850293 0.90 BCAT1 (0.39) LMNAPPOXBCAT2BCAT1DHODH
SCHEMBL4572166 0.88 UGCG (0.36) MAPK8UGCGCYP3A4BCAT2BCAT1
SCHEMBL6641349 0.87 LMNA (0.35) LMNAPPOXDHODH
SCHEMBL6641668 0.87 BCAT1 (0.34) MAPK8UGCGCYP3A4BCAT2BCAT1
SCHEMBL121222 0.87 PPOX (0.41) MAPK8UGCGCYP3A4PPOXBCAT2
SCHEMBL29351496 0.87 PPOX (0.41) MAPK8UGCGCYP3A4PPOXBCAT2
SCHEMBL2594502 0.86 BCAT1 (0.41) MAPK8UGCGCYP3A4PPOXBCAT2
SCHEMBL6644010 0.86 GPBAR1 (0.35) LMNAPPOXBCAT2BCAT1DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1122244-B1 Uracil compounds and their use SUMITOMO CHEMICAL CO (JP) 2004-09-29 EP disclosed
US-6537948-B1 Have a wide range of herbicidal spectrum, and causes no phytotoxicity on crops SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-25 US disclosed
EP-1122244-A1 Uracil compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-08-08 EP disclosed