SCHEMBL7204496

SCHEMBL7204496

C#Cc1cn([C@@H]2O[C@H](C)[C@@H](O)[C@H]2O)c(=O)nc1NC(=O)OCCSc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
ADK P55263 14/20 0.46
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
P2RY6 Q15077 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL8192179 1.00 LMNA (0.54) LMNAADKALDH1A1TSHRP2RY6
SCHEMBL7209579 0.89 LMNA (0.58) LMNAADKTSHRP2RY6SMN1; SMN2
SCHEMBL8214201 0.89 LMNA (0.58) LMNAADKTSHRP2RY6SMN1; SMN2
SCHEMBL3821161 0.88 LMNA (0.56) LMNAADKP2RY6
SCHEMBL7204636 0.87 LMNA (0.56) LMNAADKALDH1A1TSHRSMN1; SMN2
SCHEMBL7204792 0.87 LMNA (0.59) LMNAADKTSHRP2RY6SMN1; SMN2
SCHEMBL8192157 0.87 LMNA (0.59) LMNAADKTSHRP2RY6SMN1; SMN2
SCHEMBL8197032 0.87 LMNA (0.56) LMNAADKALDH1A1TSHRSMN1; SMN2
SCHEMBL3817196 0.86 LMNA (0.53) LMNAADKP2RY6
SCHEMBL3820963 0.86 LMNA (0.66) LMNAADKTSHRP2RY6SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1060183-B1 5'-DEOXYCYTIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2003-04-23 EP claimed
EP-1060183-B1 5'-DEOXYCYTIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2003-04-23 EP disclosed
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