SCHEMBL6901255

SCHEMBL6901255

CN(C)CC1OC(n2cnc3c(N)ncnc32)C(O)C1O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DOT1L Q8TEK3 2/20 0.80
DPP4 P27487 1/20 0.74
MEN1 O00255 1/20 0.74
SLC28A1 O00337 1/20 0.74
MAP3K7 O43318 1/20 0.74
SLC28A2 O43868 1/20 0.74
GAPDH P04406 1/20 0.74
ADORA3 P0DMS8 1/20 0.74
MAPK1 P28482 1/20 0.74
ADORA2A P29274 1/20 0.74
ADORA2B P29275 1/20 0.74
ADORA1 P30542 1/20 0.74
STAT6 P42226 1/20 0.74
PI4KA P42356 1/20 0.74
KMT2A Q03164 1/20 0.74
SMN1; SMN2 Q16637 1/20 0.74
PI4K2B Q8TCG2 1/20 0.74
SLC29A1 Q99808 1/20 0.74
PI4K2A Q9BTU6 1/20 0.74
SLC28A3 Q9HAS3 1/20 0.74

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
SCHEMBL952929 1.00 DOT1L (0.80) DOT1LDPP4MEN1SLC28A1MAP3K7
SCHEMBL952928 1.00 DOT1L (0.80) DOT1LDPP4MEN1SLC28A1MAP3K7
SCHEMBL19111327 0.90 AMD1 (0.80) DOT1LDPP4MEN1SLC28A1MAP3K7
SCHEMBL17859778 0.90 DOT1L (0.75) DOT1LDPP4MEN1SLC28A1MAP3K7
SCHEMBL16202796 0.89 DOT1L (1.00) DOT1LDPP4MEN1SLC28A1MAP3K7
Adenosine SCHEMBL27839942 0.88 ADORA3 (0.91) DOT1LDPP4MEN1SLC28A1MAP3K7
SCHEMBL13986400 0.88 AMD1 (0.80) DOT1LDPP4MEN1SLC28A1MAP3K7
SCHEMBL954272 0.88 AMD1 (0.80) DOT1LDPP4MEN1SLC28A1MAP3K7
SCHEMBL954273 0.88 AMD1 (0.80) DOT1LDPP4MEN1SLC28A1MAP3K7
SCHEMBL16129513 0.88 DOT1L (0.64) DOT1LDPP4MEN1SLC28A1MAP3K7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013083813-A2 MODULATORS OF SPERMINE/SPERMIDINE N'-ACETYLTRANSFERASE (SSAT) AND SSAT ASSOCIATED PROTEINS FOR USE IN PREVENTION OR TREATMENT OF RHEUMATOID ARTHRITIS Universität Zürich (CH) 2013-06-13 WO disclosed
WO-2013083813-A2 MODULATORS OF SPERMINE/SPERMIDINE N'-ACETYLTRANSFERASE (SSAT) AND SSAT ASSOCIATED PROTEINS FOR USE IN PREVENTION OR TREATMENT OF RHEUMATOID ARTHRITIS Universität Zürich (CH) 2013-06-13 WO disclosed
EP-1482977-A1 COMBINATION THERAPIES FOR TREATING METHYLTHIOADENOSINE PHOSPHORYLASE DEFICIENT CELLS PFIZER INC. (US) 2004-12-08 EP disclosed
US-20040043959-A1 Combination therapies for treating methylthioadenosine phosphorylase deficient cells AGOURON PHARMACEUTICALS INC. 2004-03-04 US disclosed
WO-2003074083-A1 COMBINATION THERAPIES FOR TREATING METHYLTHIOADENOSINE PHOSPHORYLASE DEFICIENT CELLS PFIZER INC. (US) 2003-09-12 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-20040043959-A1 Combination therapies for treating methylthioadenosine phosphorylase deficient cells APRT, MTAP, TYMP DOT1L 1250/4885DPP4 1351/4885MEN1 1363/4885

“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.