SCHEMBL6644384

SCHEMBL6644384

COC(=O)COc1nc(Oc2cc(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)c(F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.31
MEN1 O00255 1/20 0.31
TTR P02766 1/20 0.31
PPOX P50336 1/20 0.31
KMT2A Q03164 1/20 0.31
P2RX3 P56373 1/20 0.31
TXNRD1 Q16881 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL6642448 0.88 PLA2G7 (0.31) PPOXP2RX3
SCHEMBL6643186 0.86 PIN1 (0.38) MEN1KMT2A
SCHEMBL6638783 0.86 PLA2G7 (0.33) PPOXP2RX3
SCHEMBL6639185 0.85 DHODH (0.34) PPOXP2RX3SMN1; SMN2
SCHEMBL6641538 0.85 TXNRD1 (0.34) MEN1KMT2ATXNRD1SMN1; SMN2
SCHEMBL6640939 0.83 MAPT (0.32) MAPT
SCHEMBL6641209 0.83 LMNA (0.32) PPOX
SCHEMBL6638308 0.82 LMNA (0.34) PPOX
SCHEMBL6637715 0.81 ACACB (0.34) PPOXP2RX3SMN1; SMN2
SCHEMBL3825548 0.81 MAPK8 (0.35) PPOX

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