SCHEMBL825895

SCHEMBL825895

CCC(C)(C)Oc1nc(N)nc2ccc(-c3ccc(C(=O)NOC)cc3)nc12

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 6/20 0.34
MKNK1 Q9BUB5 5/20 0.34
MAP4K4 O95819 3/20 0.34
TLR8 Q9NR97 3/20 0.33
TLR7 Q9NYK1 2/20 0.33
DHFR P00374 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
MAPK13 O15264 1/20 0.32
MAPK12 P53778 1/20 0.32
MAPK11 Q15759 1/20 0.32
MAPK14 Q16539 1/20 0.32
GSTP1 P09211 2/20 0.32
GSTM2 P28161 2/20 0.32
MCHR1 Q99705 1/20 0.31

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
SCHEMBL826101 0.90 MAP4K4 (0.38) MKNK2MKNK1MAP4K4
SCHEMBL826145 0.90 MKNK2 (0.36) MKNK2MKNK1MAP4K4PDE4APDE4B
SCHEMBL826435 0.89 MKNK2 (0.43) MKNK2MKNK1MAP4K4
SCHEMBL825927 0.87 MKNK1 (0.43) MKNK2MKNK1MAP4K4MAPK14
SCHEMBL826328 0.87 HDAC4 (0.40) MKNK2MKNK1TLR8TLR7MAPK14
SCHEMBL826099 0.87 MKNK1 (0.40) MKNK2MKNK1TLR8TLR7
SCHEMBL823761 0.85 MKNK2 (0.38) MKNK2MKNK1MAP4K4TLR8TLR7
SCHEMBL825728 0.85 MKNK1 (0.44) MKNK2MKNK1MAP4K4
SCHEMBL826265 0.84 MKNK1 (0.44) MKNK2MKNK1MAP4K4
SCHEMBL823734 0.82 MKNK2 (0.41) MKNK2MKNK1MAP4K4PDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US claimed
US-8143394-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2012-03-27 US disclosed
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US disclosed
WO-2008077649-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTONS GILEAD SCIENCES, INC. (US) 2008-07-03 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-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS PNPO, DPYD, PLPBP MKNK2 3173/4885MKNK1 3271/4885MAP4K4 2930/4885

“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.