SCHEMBL8192203

SCHEMBL8192203

CC(=O)OC1C(OC(C)=O)[C@@H](C)O[C@H]1n1cc(I)c(NC(=O)OCC2CCC2)nc1=O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
THRB P10828 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 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
SCHEMBL8193206 0.98 LMNA (0.41) LMNATHRBSMN1; SMN2HIF1ATDP1
SCHEMBL7210264 0.98 LMNA (0.41) LMNATHRBSMN1; SMN2HIF1ATDP1
SCHEMBL7209690 0.96 LMNA (0.42) LMNATHRBSMN1; SMN2HIF1ATDP1
SCHEMBL8192660 0.96 LMNA (0.42) LMNATHRBSMN1; SMN2HIF1ATDP1
SCHEMBL7211564 0.88 LMNA (0.37) LMNASMN1; SMN2ALDH1A1
SCHEMBL3817265 0.87 LMNA (0.46) LMNATHRBSMN1; SMN2HIF1ATDP1
SCHEMBL285261 0.87 LMNA (0.51) LMNATHRBSMN1; SMN2HIF1ATDP1
SCHEMBL3817191 0.86 LMNA (0.51) LMNATHRBSMN1; SMN2HIF1ATDP1
SCHEMBL8184942 0.86 LMNA (0.55) LMNA
SCHEMBL7209492 0.86 LMNA (0.55) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1060183-A1 5'-DEOXYCYTIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-12-20 EP disclosed
WO-1999040099-A1 5'-DEOXYCYTIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1999-08-12 WO disclosed