SCHEMBL6907689

SCHEMBL6907689

CC(SC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O)c1ccccn1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AHCY P23526 7/20 0.64
NADK O95544 1/20 0.64
DOT1L Q8TEK3 2/20 0.59
PNMT P11086 1/20 0.59
DNMT1 P26358 1/20 0.59
DNMT3B Q9UBC3 1/20 0.59
AMD1 P17707 1/20 0.59
SRM P19623 3/20 0.59
SMS P52788 1/20 0.59
DPP4 P27487 1/20 0.58

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
SCHEMBL6935387 0.85 AHCY (0.78) AHCYNADKDOT1LPNMTDNMT1
SCHEMBL6893100 0.84 AHCY (0.70) AHCYNADKDOT1LPNMTDNMT1
SCHEMBL1490897 0.84 AHCY (0.76) AHCYNADKDOT1LPNMTDNMT1
SCHEMBL8943648 0.83 AHCY (0.74) AHCYNADKDOT1LPNMTDNMT1
SCHEMBL8943568 0.83 AHCY (0.74) AHCYNADKDOT1LPNMTDNMT1
SCHEMBL8943736 0.83 AHCY (0.74) AHCYNADKDOT1LPNMTDNMT1
SCHEMBL3488878 0.81 AHCY (0.78) AHCYNADKDOT1LPNMTDNMT1
SCHEMBL5055541 0.80 AHCY (0.76) AHCYNADKDOT1LPNMTDNMT1
SCHEMBL6908163 0.80 AHCY (0.76) AHCYNADKDOT1LPNMTDNMT1
Methylthioadenosine SCHEMBL20798030 0.80 AHCY (0.83) AHCYNADKDOT1LPNMTDNMT1

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 AHCY 62/4885NADK 1514/4885DOT1L 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.