SCHEMBL285261

SCHEMBL285261

CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@@H](C)O[C@H]1n1cc(F)c(NC(=O)OCC2CCCCC2)nc1=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
MGLL Q99685 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
THRB P10828 1/20 0.34
HIF1A Q16665 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
CHRM3 P20309 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
NT5E P21589 1/20 0.30
P2RY6 Q15077 1/20 0.30
P2RY14 Q15391 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
SCHEMBL8193206 0.89 LMNA (0.41) LMNASMN1; SMN2THRBHIF1ATDP1
SCHEMBL7210264 0.89 LMNA (0.41) LMNASMN1; SMN2THRBHIF1ATDP1
SCHEMBL8192203 0.87 LMNA (0.41) LMNASMN1; SMN2THRBHIF1ATDP1
SCHEMBL284985 0.86 LMNA (0.69) LMNAMGLLSMN1; SMN2MAPTNT5E
SCHEMBL284984 0.86 LMNA (0.69) LMNAMGLLSMN1; SMN2MAPTNT5E
SCHEMBL8192660 0.85 LMNA (0.42) LMNASMN1; SMN2THRBHIF1ATDP1
SCHEMBL7209690 0.85 LMNA (0.42) LMNASMN1; SMN2THRBHIF1ATDP1
SCHEMBL285510 0.85 LMNA (0.65) LMNASMN1; SMN2THRBHIF1ATDP1
SCHEMBL9413897 0.85 LMNA (0.45) LMNASMN1; SMN2ALDH1A1MAPTMEN1
SCHEMBL9057265 0.84 LMNA (0.54) LMNASMN1; SMN2THRBHIF1ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2428213-A1 STABILIZED CHLORITE SOLUTIONS IN COMBINATION WITH FLUOROPYRIMIDINES FOR USE IN CANCER TREATMENT Nuvo Research AG (CH) 2012-03-14 EP claimed
EP-0602454-B1 N-Oxycarbonyl substituted 5'-deoxy-5-fluorocytidines HOFFMANN LA ROCHE (CH) 1996-04-24 EP claimed
EP-0602454-A1 N-Oxycarbonyl substituted 5'-deoxy-5-fluorocytidines F. HOFFMANN-LA ROCHE AG (CH) 1994-06-22 EP claimed
EP-2428213-A1 STABILIZED CHLORITE SOLUTIONS IN COMBINATION WITH FLUOROPYRIMIDINES FOR USE IN CANCER TREATMENT Nuvo Research AG (CH) 2012-03-14 EP disclosed
EP-0602454-B1 N-Oxycarbonyl substituted 5'-deoxy-5-fluorocytidines HOFFMANN LA ROCHE (CH) 1996-04-24 EP disclosed
EP-0602454-A1 N-Oxycarbonyl substituted 5'-deoxy-5-fluorocytidines F. HOFFMANN-LA ROCHE AG (CH) 1994-06-22 EP disclosed