SCHEMBL6885486

SCHEMBL6885486

O=c1[nH]c(=O)n([C@]2(I)O[C@H](CO)[C@@H](O)[C@H]2O)cc1F

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
PYGM P11217 3/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 1/20 0.39
PMP22 Q01453 1/20 0.39
HBB P68871 1/20 0.39
TK2 O00142 2/20 0.37
TK1 P04183 1/20 0.36
NT5E P21589 1/20 0.35
P2RY6 Q15077 1/20 0.35
P2RY14 Q15391 1/20 0.35
ALOX12 P18054 1/20 0.34
ADRA1A P35348 1/20 0.34

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
SCHEMBL1740177 0.84 LMNA (0.47) LMNASMN1; SMN2PYGMTSHRMAPT
SCHEMBL6537910 0.82 LMNA (0.46) LMNASMN1; SMN2PYGMTSHRMAPT
SCHEMBL6882254 0.81 TK2 (0.56) TSHRPMP22TK2TK1
SCHEMBL6882248 0.81 TK2 (0.56) TSHRPMP22TK2TK1
SCHEMBL6885381 0.80 TK2 (0.45) PYGMTSHRPMP22TK2TK1
SCHEMBL123663 0.77 SLC28A1 (0.49) P2RY6P2RY14
SCHEMBL35210374 0.75 SLC28A1 (0.36) PYGMP2RY14
SCHEMBL9769161 0.74 LMNA (0.38) LMNASMN1; SMN2PYGMTSHRMAPT
SCHEMBL7617383 0.74 LMNA (0.40) LMNASMN1; SMN2PYGMTSHRMAPT
SCHEMBL28551951 0.74 LMNA (0.51) LMNASMN1; SMN2TSHRMAPTPMP22

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-1411954-A2 MODIFIED NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION Pharmasset Limited (BB) 2004-04-28 EP disclosed
WO-2002032920-A2 MODIFIED NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION PHARMASSET LIMITED (BB) 2002-04-25 WO disclosed