SCHEMBL5464348

SCHEMBL5464348

Nc1nc(C2CCCC2)nc2c1nc(O)n2Cc1cccc(CC(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE8B O95263 14/20 0.40
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
MAPK1 P28482 1/20 0.36
AURKA O14965 1/20 0.36
CDK4 P11802 1/20 0.36
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL5468331 0.89 TLR7 (0.45) PDE8B
SCHEMBL19423854 0.85 PDE8B (0.47) PDE8BMAPK1CNR1CNR2
SCHEMBL5731724 0.85 PDE8B (0.47) PDE8BMAPK1CNR1CNR2
SCHEMBL18431198 0.85 PDE8B (0.47) PDE8BMAPK1CNR1CNR2
SCHEMBL2060546 0.82 MAPK1 (0.38) ITGB3ITGA2BMAPK1
SCHEMBL10309736 0.82 TLR7 (0.44) ITGB3ITGA2B
SCHEMBL5472433 0.82 TLR7 (0.40) ITGB3ITGA2B
SCHEMBL5730647 0.81 PDE8B (0.50) PDE8BMAPK1
SCHEMBL5468415 0.81 TLR7 (0.41)
SCHEMBL5457974 0.81 TLR7 (0.42) ITGB3ITGA2BMAPK1

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 5 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

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 PDE8B 431/4885ITGB3 3332/4885ITGA2B 3715/4885

“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.