SCHEMBL20009992

SCHEMBL20009992

C=P(C)(C)CC(C)[C@H]1O[C@@H](n2cnc3c(N)ccnc32)[C@@](C)(O)[C@@H]1O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 8/20 0.43
▸ ADORA2B P29275 3/20 0.40
▸ ADORA3 P0DMS8 8/20 0.39
▸ AHCY P23526 1/20 0.39
▸ ADA P00813 2/20 0.37
▸ DNMT1 P26358 1/20 0.37
▸ DNMT3B Q9UBC3 1/20 0.37
▸ ADORA1 P30542 4/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL20010088 1.00 ADORA2A (0.43) ADORA2AADORA2BADORA3AHCYADA
SCHEMBL15868513 0.81 ADORA2A (0.52) ADORA2AADORA2BADORA3AHCYADA
SCHEMBL14946110 0.81 ADORA2A (0.52) ADORA2AADORA2BADORA3AHCYADA
SCHEMBL14929096 0.81 ADORA2A (0.52) ADORA2AADORA2BADORA3AHCYADA
SCHEMBL14946104 0.81 ADORA2A (0.52) ADORA2AADORA2BADORA3AHCYADA
SCHEMBL15868489 0.81 ADORA2A (0.52) ADORA2AADORA2BADORA3AHCYADA
SCHEMBL14928477 0.81 ADORA2A (0.52) ADORA2AADORA2BADORA3AHCYADA
SCHEMBL18852312 0.81 ADORA2A (0.52) ADORA2AADORA2BADORA3AHCYADA
SCHEMBL18852326 0.81 ADORA2A (0.52) ADORA2AADORA2BADORA3AHCYADA
SCHEMBL20010089 0.80 ADORA2A (0.47) ADORA2AADORA2BAHCYADADNMT1

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-20180086807-A1 MODIFIED POLYNUCLEOTIDES FOR THE PRODUCTION OF PROTEINS ASSOCIATED WITH HUMAN DISEASE MODERNATX, INC. 2018-03-29 — — 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-20180086807-A1 MODIFIED POLYNUCLEOTIDES FOR THE PRODUCTION OF PROTEINS ASSOCIATED WITH HUMAN DISEASE POLRMT, POLM, POLN ADORA2A 3329/4885ADORA2B 3118/4885ADORA3 3596/4885

“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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