SCHEMBL749583

SCHEMBL749583

C[C@]1(CO)O[C@@H](n2cnc3c(N)ncnc32)[C@@H](F)[C@@H]1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 2/20 0.56
PI4K2B Q8TCG2 2/20 0.56
PI4K2A Q9BTU6 2/20 0.56
PI4KB Q9UBF8 2/20 0.56
ADORA3 P0DMS8 5/20 0.54
ADORA2A P29274 4/20 0.54
SLC28A1 O00337 2/20 0.54
SLC28A2 O43868 2/20 0.54
DPP4 P27487 1/20 0.54
MEN1 O00255 1/20 0.54
MAP3K7 O43318 1/20 0.54
GAPDH P04406 1/20 0.54
MAPK1 P28482 1/20 0.54
ADORA2B P29275 1/20 0.54
ADORA1 P30542 1/20 0.54
STAT6 P42226 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
DOT1L Q8TEK3 1/20 0.54
SLC29A1 Q99808 1/20 0.54

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
SCHEMBL749584 1.00 PI4KA (0.56) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL13146051 1.00 PI4KA (0.56) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL3436912 0.88 PRMT5 (0.65) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL6426564 0.88 PRMT5 (0.65) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL2318607 0.88 PRMT5 (0.65) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL29815824 0.88 PRMT5 (0.65) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL14946260 0.88 PRMT5 (0.65) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL14853754 0.88 PRMT5 (0.65) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL13146052 0.87 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL12170639 0.87 PI4KA (0.57) PI4KAPI4K2BPI4K2API4KBADORA3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120149657-A1 2'-FLUORO ARABINO NUCLEOSIDES AND USE THEREOF SOUTHERN RESEARCH INSTITUTE (AL) 2012-06-14 US claimed
EP-2430034-A1 2'-FLUORO ARABINO NUCLEOSIDES AND USE THEREOF Southern Research Institute (US) 2012-03-21 EP claimed
WO-2010132513-A1 2'-FLUORO ARABINO NUCLEOSIDES AND USE THEREOF SOUTHERN RESEARCH INSTITUTE (US) 2010-11-18 WO claimed
US-20120149657-A1 2'-FLUORO ARABINO NUCLEOSIDES AND USE THEREOF SOUTHERN RESEARCH INSTITUTE (AL) 2012-06-14 US disclosed
EP-2430034-A1 2'-FLUORO ARABINO NUCLEOSIDES AND USE THEREOF Southern Research Institute (US) 2012-03-21 EP disclosed
WO-2010132513-A1 2'-FLUORO ARABINO NUCLEOSIDES AND USE THEREOF SOUTHERN RESEARCH INSTITUTE (US) 2010-11-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120149657-A1 2'-FLUORO ARABINO NUCLEOSIDES AND USE THEREOF SLC29A2, DUT, SLC29A1 PI4KA 1842/4885PI4K2B 1534/4885PI4K2A 1592/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.