SCHEMBL6639677

SCHEMBL6639677

CCOC(=O)C(C)Oc1ccnc(Oc2cc(O)c(F)cc2Cl)n1.N=C=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPOX P50336 3/20 0.40
TSHR P16473 1/20 0.33
KMT2A Q03164 3/20 0.32
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
TDP1 Q9NUW8 2/20 0.31
GAA P10253 1/20 0.31
RXRA P19793 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
LMNA P02545 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
SCHEMBL6639776 0.85 PPOX (0.40) PPOXTSHRKMT2AALDH1A1MEN1
SCHEMBL6637642 0.85 PPOX (0.38) PPOXTSHRKMT2AALDH1A1MEN1
SCHEMBL6672101 0.80 PPOX (0.36) PPOXTSHRKMT2AALDH1A1MEN1
SCHEMBL6638493 0.76 BCAT1 (0.44) PPOX
SCHEMBL6638642 0.76 MEN1 (0.37) KMT2AALDH1A1MEN1SMN1; SMN2L3MBTL1
SCHEMBL6640252 0.76 MEN1 (0.38) TSHRKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL6636961 0.74 PPOX (0.41) PPOXTSHR
SCHEMBL6637880 0.70 PPOX (0.37) PPOXKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL6664050 0.70 MEN1 (0.38) TSHRKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL6641028 0.70 PPOX (0.40) PPOXKMT2AALDH1A1MEN1SMN1; SMN2

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 1 patent. 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