SCHEMBL18072191

SCHEMBL18072191

[N-]=[N+]=N[C@]1(CO)OC(n2cnc3c(=O)[nH]c(N)nc32)[C@H](F)[C@@H]1O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.48
▸ STING1 Q86WV6 11/20 0.45
▸ NT5E P21589 1/20 0.45
▸ PDE3B Q13370 1/20 0.44
▸ PDE3A Q14432 1/20 0.44
▸ HINT1 P49773 1/20 0.43

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
SCHEMBL16858617 1.00 ADORA3 (0.48) ADORA3STING1NT5EPDE3BPDE3A
SCHEMBL16858614 1.00 ADORA3 (0.48) ADORA3STING1NT5EPDE3BPDE3A
SCHEMBL16214090 1.00 ADORA3 (0.48) ADORA3STING1NT5EPDE3BPDE3A
SCHEMBL18022446 0.92 HINT1 (0.46) ADORA3STING1NT5EPDE3BPDE3A
SCHEMBL15798626 0.91 ADORA3 (0.52) ADORA3STING1NT5EPDE3BPDE3A
SCHEMBL13523557 0.91 ADORA3 (0.52) ADORA3STING1NT5EPDE3BPDE3A
SCHEMBL16214160 0.91 ADORA3 (0.52) ADORA3STING1NT5EPDE3BPDE3A
SCHEMBL16305900 0.90 ADORA3 (0.49) ADORA3STING1NT5EPDE3BPDE3A
SCHEMBL16292038 0.90 ADORA3 (0.49) ADORA3STING1NT5EPDE3BPDE3A
Phosphoric Acid SCHEMBL21465165 0.88 NT5E (0.50) ADORA3STING1NT5EPDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160264610-A1 AZIDO NUCLEOSIDES AND NUCLEOTIDE ANALOGS ALIOS BIOPHARMA INC (US) 2016-09-15 — — US disclosed
WO-2012040124-A1 AZIDO NUCLEOSIDES AND NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-03-29 — — 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-20160264610-A1 AZIDO NUCLEOSIDES AND NUCLEOTIDE ANALOGS PNP, ADA, ADAR ADORA3 20/4885STING1 418/4885NT5E 15/4885

“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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