SCHEMBL7204792

SCHEMBL7204792

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

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
ADK P55263 9/20 0.43
P2RY6 Q15077 4/20 0.32
TSHR P16473 1/20 0.31
MAPT P10636 1/20 0.31
PMP22 Q01453 1/20 0.31
HBB P68871 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
P2RY14 Q15391 2/20 0.31
NT5E P21589 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
SCHEMBL8192157 1.00 LMNA (0.59) LMNAADKP2RY6TSHRMAPT
SCHEMBL8214201 0.91 LMNA (0.58) LMNAADKP2RY6TSHRMAPT
SCHEMBL7209579 0.91 LMNA (0.58) LMNAADKP2RY6TSHRMAPT
SCHEMBL3820963 0.90 LMNA (0.66) LMNAADKP2RY6TSHRMAPT
SCHEMBL3825870 0.88 LMNA (0.60) LMNAADKP2RY6TSHRMAPT
SCHEMBL7207507 0.88 LMNA (0.61) LMNAADKP2RY6TSHRMAPT
SCHEMBL3821913 0.88 LMNA (0.76) LMNAADK
SCHEMBL7205091 0.88 LMNA (0.60) LMNAADKP2RY6TSHRMAPT
SCHEMBL8198722 0.88 LMNA (0.60) LMNAADKP2RY6TSHRMAPT
SCHEMBL8192179 0.87 LMNA (0.54) LMNAADKP2RY6TSHRMAPT

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