SCHEMBL7204488

SCHEMBL7204488

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

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
ADK P55263 11/20 0.41
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

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
SCHEMBL8184063 1.00 LMNA (0.60) LMNAADKTSHRMAPTPMP22
SCHEMBL7205800 0.92 LMNA (0.61) LMNAADK
SCHEMBL8196590 0.92 LMNA (0.61) LMNAADK
SCHEMBL7205759 0.90 LMNA (0.62) LMNAADKTSHRMAPTPMP22
SCHEMBL8199285 0.90 LMNA (0.62) LMNAADKTSHRMAPTPMP22
SCHEMBL8196994 0.89 LMNA (0.55) LMNAADK
SCHEMBL7209660 0.89 LMNA (0.55) LMNAADK
SCHEMBL3821913 0.89 LMNA (0.76) LMNAADK
SCHEMBL3824216 0.88 LMNA (0.75) LMNAADK
SCHEMBL3819223 0.88 LMNA (0.75) LMNAADK

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