SCHEMBL6886972

SCHEMBL6886972

OC[C@@H]1C[C@@H](O)[C@H](c2nc3ncnc(Cl)c3[nH]2)O1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.35
NAE1 Q13564 2/20 0.32
UBA3 Q8TBC4 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GMNN O75496 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
STAT6 P42226 1/20 0.32
HIF1A Q16665 1/20 0.32
SLC5A2 P31639 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
SCHEMBL6887365 0.84 TP53 (0.35) NAE1UBA3SMN1; SMN2
SCHEMBL9657348 0.78 HIF1A (0.54) KDM4EGMNNLMNAMAPTBLM
SCHEMBL1796867 0.78 HIF1A (0.54) KDM4EGMNNLMNAMAPTBLM
SCHEMBL6880948 0.75 BCHE (0.33)
SCHEMBL6886930 0.69 KDM4E (0.38) EGLN1KDM4EGMNNLMNAMAPT
SCHEMBL1198767 0.67 EGLN1 (0.36) EGLN1LMNATSHR
SCHEMBL11422145 0.67 HIF1A (0.47) KDM4EGMNNLMNAMAPTBLM
SCHEMBL12541692 0.66 HIF1A (0.33) LMNASMN1; SMN2HIF1A
SCHEMBL4279999 0.65 GRIN2B (0.41) LMNASMN1; SMN2HIF1A
SCHEMBL6886970 0.65 SLC5A2 (0.32) SLC5A2

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