SCHEMBL2060130

SCHEMBL2060130

COCCOc1nc(N)c2ncn(Cc3cccc(CC(=O)OC)c3)c2n1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 15/20 0.66
YTHDC1 Q96MU7 3/20 0.45
PNP P00491 1/20 0.45
NUDT1 P36639 1/20 0.44
ADORA2A P29274 1/20 0.43
ADORA1 P30542 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
SCHEMBL5469427 0.93 TLR7 (0.56) TLR7YTHDC1PNPADORA2AADORA1
SCHEMBL5464178 0.92 TLR7 (0.56) TLR7YTHDC1PNPADORA2AADORA1
SCHEMBL5462373 0.92 TLR7 (0.56) TLR7YTHDC1ADORA2AADORA1
SCHEMBL5468212 0.92 TLR7 (0.57) TLR7YTHDC1PNPADORA2AADORA1
SCHEMBL5462443 0.90 TLR7 (0.54) TLR7YTHDC1PNPADORA2AADORA1
SCHEMBL5470479 0.90 TLR7 (0.54) TLR7YTHDC1PNPADORA2AADORA1
SCHEMBL5465289 0.89 TLR7 (0.52) TLR7YTHDC1PNPADORA2AADORA1
SCHEMBL5471916 0.88 TLR7 (0.54) TLR7YTHDC1PNPADORA2AADORA1
SCHEMBL5465096 0.88 TLR7 (0.55) TLR7YTHDC1PNPADORA2AADORA1
SCHEMBL5463295 0.88 TLR7 (0.55) TLR7YTHDC1PNPADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178743-A1 NOVEL ADENINE COMPOUND AND USE THEREOF DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-07-12 US disclosed
EP-1550662-B1 ADENINE COMPOUND AND USE THEREOF DAINIPPON SUMITOMO PHARMA CO (JP) 2012-07-04 EP disclosed
US-8148371-B2 Adenine compound and use thereof DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-04-03 US disclosed
US-20100256118-A1 NOVEL ADENINE COMPOUND AND USE THEREOF DAINIPPON SUMITOMO PHARMA CO.,LTD. (JP) 2010-10-07 US disclosed
US-7754728-B2 Adenine compound and use thereof DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-07-13 US disclosed
US-20060052403-A1 Novel adenine compound and use thereof DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2006-03-09 US disclosed
EP-1550662-A1 NOVEL ADENINE COMPOUND AND USE THEREOF SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-07-06 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 (3 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-20100256118-A1 NOVEL ADENINE COMPOUND AND USE THEREOF ADORA1, P2RY10, HRH4 TLR7 265/4885YTHDC1 2506/4885PNP 1662/4885
US-20060052403-A1 Novel adenine compound and use thereof ADORA1, P2RY10, HRH4 TLR7 265/4885YTHDC1 2506/4885PNP 1662/4885
US-20120178743-A1 NOVEL ADENINE COMPOUND AND USE THEREOF ADORA1, HRH4, P2RY10 TLR7 252/4885YTHDC1 2271/4885PNP 1308/4885

“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.