SCHEMBL6907808

SCHEMBL6907808

Nc1ncnc2c1ncn2[C@H]1O[C@@H](CSCc2ccco2)[C@H](O)[C@H]1O

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DOT1L Q8TEK3 3/20 0.69
AHCY P23526 6/20 0.68
NADK O95544 1/20 0.68
DNMT3B Q9UBC3 2/20 0.68
PNMT P11086 1/20 0.68
DNMT1 P26358 1/20 0.68
GNMT Q14749 3/20 0.68
PRMT7 Q9NVM4 1/20 0.66
DPP4 P27487 1/20 0.61

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
SCHEMBL17551942 0.85 GNMT (0.80) DOT1LAHCYNADKDNMT3BPNMT
SCHEMBL6901855 0.85 GNMT (0.80) DOT1LAHCYNADKDNMT3BPNMT
SCHEMBL19434095 0.85 GNMT (0.80) DOT1LAHCYNADKDNMT3BPNMT
SCHEMBL9550942 0.85 GNMT (0.80) DOT1LAHCYNADKDNMT3BPNMT
SCHEMBL21311164 0.83 ADORA3 (0.70) DOT1LAHCYNADKDNMT3BPNMT
SCHEMBL3299462 0.83 ADORA1 (0.61) DOT1LAHCYNADKDPP4
SCHEMBL6904454 0.83 AHCY (0.68) DOT1LAHCYNADKDNMT3BPNMT
SCHEMBL21243035 0.83 DOT1L (0.84) DOT1LAHCYNADKDNMT3BPNMT
SCHEMBL6900787 0.82 GNMT (0.69) DOT1LAHCYNADKDNMT3BPNMT
SCHEMBL6902821 0.82 GNMT (0.74) DOT1LAHCYNADKDNMT3BPNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040043959-A1 Combination therapies for treating methylthioadenosine phosphorylase deficient cells AGOURON PHARMACEUTICALS INC. 2004-03-04 US 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 1250/4885AHCY 62/4885NADK 1514/4885

“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.