SCHEMBL14429136

SCHEMBL14429136

C[C@]1(O)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H](COCc2ccccc2)O[C@H]1n1cnc2c(N)ncnc21

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 4/20 0.56
▸ ADORA3 P0DMS8 3/20 0.51
▸ PDE2A O00408 2/20 0.50
▸ HSPA5 P11021 1/20 0.46
▸ AHCY P23526 2/20 0.46
▸ ADORA1 P30542 2/20 0.43
▸ DOT1L Q8TEK3 2/20 0.42

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
SCHEMBL14429134 1.00 ADORA2A (0.56) ADORA2AADORA3PDE2AHSPA5AHCY
SCHEMBL14429149 0.90 ADORA3 (0.49) ADORA2AADORA3PDE2AADORA1
SCHEMBL18671451 0.84 AHCY (0.49) ADORA2AADORA3PDE2AHSPA5AHCY
SCHEMBL11427985 0.83 PDE2A (0.64) ADORA2AADORA3PDE2AHSPA5AHCY
SCHEMBL5961364 0.83 PDE2A (0.64) ADORA2AADORA3PDE2AHSPA5AHCY
SCHEMBL14429135 0.83 ADORA2A (0.68) ADORA2AADORA3AHCYADORA1DOT1L
SCHEMBL14440591 0.81 ADORA2A (0.55) ADORA2AADORA3AHCYADORA1
SCHEMBL14440593 0.81 ADORA2A (0.55) ADORA2AADORA3AHCYADORA1
SCHEMBL14428965 0.81 PDE2A (0.59) ADORA2AADORA3PDE2AHSPA5AHCY
SCHEMBL14429057 0.81 PDE2A (0.59) ADORA3PDE2AHSPA5AHCYADORA1

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-20070185063-A1 Seven-membered ring nucleosides IDENIX PHARMACEUTICALS, INC. 2007-08-09 — — 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-20070185063-A1 Seven-membered ring nucleosides NSUN2, NSUN3, HAVCR2 ADORA2A 566/4885ADORA3 332/4885PDE2A 3198/4885

“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.

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