SCHEMBL1243814

SCHEMBL1243814

CCCCOc1nc(N)c2[nH]c(=O)n(CCCN(CCN3CCOCC3)Cc3cccc(C(C)C(=O)O)c3)c2n1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 20/20 0.62
IL6 P05231 2/20 0.49

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
SCHEMBL2389902 0.98 TLR7 (0.63) TLR7IL6
SCHEMBL1244771 0.98 TLR7 (0.65) TLR7IL6
SCHEMBL1244962 0.97 TLR7 (0.65) TLR7IL6
SCHEMBL2843218 0.90 TLR7 (0.65) TLR7IL6
SCHEMBL1244619 0.89 TLR7 (0.62) TLR7
SCHEMBL2389795 0.88 TLR7 (0.66) TLR7IL6
SCHEMBL2837664 0.88 TLR7 (0.68) TLR7IL6
SCHEMBL2389070 0.88 TLR7 (0.63) TLR7IL6
SCHEMBL12048706 0.88 TLR7 (0.65) TLR7
Bromide SCHEMBL3363812 0.87 TLR7 (0.67) TLR7IL6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1728793-B1 9-SUBSTITUTED 8-OXOADENINE COMPOUND SUMITOMO DAINIPPON PHARMA CO LTD (JP) 2016-02-03 EP claimed
US-8012964-B2 9-substituted 8-oxoadenine compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-09-06 US disclosed
US-20110046369-A1 METHOD FOR PREPARING ADENINE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-02-24 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-20110046369-A1 METHOD FOR PREPARING ADENINE COMPOUND AMPD2, APRT, PARP2 TLR7 368/4885IL6 2043/4885

“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.