SCHEMBL4759362

SCHEMBL4759362

CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](n2cnc3c(N)nc(OCCC4CCCCC4)nc32)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 11/20 0.61
ADORA2B P29275 10/20 0.61
ADORA3 P0DMS8 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
SCHEMBL4759681 0.83 ADORA2A (0.61) ADORA2AADORA2BADORA3
SCHEMBL4758246 0.82 ADORA2A (0.61) ADORA2AADORA2BADORA3
SCHEMBL278299 0.82 RNASEL (0.49) ADORA2AADORA2BADORA3
SCHEMBL13403857 0.82 RNASEL (0.49) ADORA2AADORA2BADORA3
SCHEMBL4759356 0.81 ADORA2A (0.65) ADORA2AADORA2BADORA3
SCHEMBL14252600 0.81 ADORA2A (0.58) ADORA2AADORA2BADORA3
SCHEMBL278666 0.81 ADORA3 (0.51) ADORA2AADORA2BADORA3
SCHEMBL13403858 0.81 ADORA3 (0.51) ADORA2AADORA2BADORA3
SCHEMBL4757814 0.81 ADORA3 (0.56) ADORA2AADORA2BADORA3
SCHEMBL6762689 0.78 ADORA1 (0.50) ADORA2AADORA2BADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7342003-B2 Synthesis of 2-aralkyloxyadenosines, 2-alkoxyadenosines, and their analogs KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. (US) 2008-03-11 US disclosed
US-7342003-B2 Synthesis of 2-aralkyloxyadenosines, 2-alkoxyadenosines, and their analogs KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. (US) 2008-03-11 US disclosed
US-20060135466-A1 Synthesis of 2-aralkyloxyadenosines, 2-alkoxyadenosines, and their analogs KING PHARMACEUTICALS RESEARCH & DEVELOPMENT, INC. 2006-06-22 US disclosed
WO-2005033121-A2 SYNTHESIS OF 2-ARALKYLOXYADENOSINES, 2-ALKOXYADENOSINES, AND THEIR ANALOGS KING PHARMACEUTICALS RESEARCH & DEVELOPMENT, INC. (US) 2005-04-14 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-20060135466-A1 Synthesis of 2-aralkyloxyadenosines, 2-alkoxyadenosines, and their analogs ADA, ADAR, DCTD ADORA2A 7/4885ADORA2B 62/4885ADORA3 44/4885

“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.