SCHEMBL6900787

SCHEMBL6900787

Cc1ccccc1CSC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GNMT Q14749 3/20 0.69
AHCY P23526 6/20 0.67
DOT1L Q8TEK3 3/20 0.67
DNMT3B Q9UBC3 2/20 0.67
NADK O95544 1/20 0.67
PNMT P11086 1/20 0.67
DNMT1 P26358 1/20 0.67
SLC29A1 Q99808 1/20 0.65
PRMT7 Q9NVM4 1/20 0.65

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
SCHEMBL9550942 0.87 GNMT (0.80) GNMTAHCYDOT1LDNMT3BNADK
SCHEMBL17551942 0.87 GNMT (0.80) GNMTAHCYDOT1LDNMT3BNADK
SCHEMBL19434095 0.87 GNMT (0.80) GNMTAHCYDOT1LDNMT3BNADK
SCHEMBL6901855 0.87 GNMT (0.80) GNMTAHCYDOT1LDNMT3BNADK
SCHEMBL6908804 0.85 AHCY (0.69) GNMTAHCYDOT1LDNMT3BNADK
SCHEMBL6899844 0.84 GNMT (0.77) GNMTAHCYDOT1LDNMT3BNADK
SCHEMBL6900840 0.84 GNMT (0.77) GNMTAHCYDOT1LDNMT3BNADK
SCHEMBL2115821 0.83 AHCY (0.79) AHCYDOT1LDNMT3BNADKPNMT
SCHEMBL998091 0.83 AHCY (0.79) AHCYDOT1LDNMT3BNADKPNMT
SCHEMBL6907808 0.82 DOT1L (0.69) GNMTAHCYDOT1LDNMT3BNADK

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 GNMT 12/4885AHCY 62/4885DOT1L 1250/4885

“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.