SCHEMBL5468415

SCHEMBL5468415

Nc1nc(OCC2CCCCC2)nc2c1nc(O)n2Cc1cccc(CC(=O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 16/20 0.41
ADORA2A P29274 1/20 0.40
ADORA2B P29275 1/20 0.40
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
MCHR1 Q99705 1/20 0.37

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
SCHEMBL5462432 0.91 TLR7 (0.52) TLR7ADORA2AADORA2B
SCHEMBL5458062 0.87 TLR7 (0.42) TLR7THRB
SCHEMBL12305239 0.85 CYP3A4 (0.47) TLR7
SCHEMBL5464223 0.85 TLR7 (0.49) TLR7ADORA2AADORA2B
SCHEMBL5467061 0.85 TLR7 (0.51) TLR7
SCHEMBL12305242 0.84 CYP3A4 (0.47) TLR7
SCHEMBL5464033 0.84 TLR7 (0.48) TLR7
SCHEMBL5459743 0.83 TLR7 (0.52) TLR7
SCHEMBL5459620 0.83 TLR7 (0.50) TLR7
SCHEMBL5476595 0.83 TLR7 (0.51) TLR7ADORA2AADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070225303-A1 8-Oxoadenine Compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-09-27 US claimed
EP-1728792-A1 8-OXOADENINE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-12-06 EP claimed
US-20070225303-A1 8-Oxoadenine Compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-09-27 US disclosed
US-20070225303-A1 8-Oxoadenine Compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-09-27 US disclosed
US-20070225303-A1 8-Oxoadenine Compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-09-27 US disclosed
EP-1728792-A1 8-OXOADENINE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-12-06 EP 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-20070225303-A1 8-Oxoadenine Compound TLR7, CCR8, TLR8 TLR7 1/4885ADORA2A 22/4885ADORA2B 38/4885

“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.