SCHEMBL4414487

SCHEMBL4414487

CCOc1nc(N)nc2ccc(-c3cccc(C(N)=O)c3)nc12

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 13/20 0.45
MAPK8 P45983 2/20 0.43
TTK P33981 1/20 0.43
CHEK2 O96017 1/20 0.43
PIK3CA P42336 1/20 0.42
MAPK9 P45984 1/20 0.42
MAPK10 P53779 1/20 0.42
PDE2A O00408 1/20 0.39
PDE5A O76074 1/20 0.39
PDE7A Q13946 1/20 0.39
PDE11A Q9HCR9 1/20 0.39
PDE10A Q9Y233 1/20 0.39
DHFR P00374 1/20 0.39
LDHB P07195 1/20 0.39
KDM1A O60341 1/20 0.38

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
SCHEMBL4425330 0.87 CHEK2 (0.45) MAP4K4MAPK8CHEK2
SCHEMBL823753 0.85 MAP4K4 (0.48) MAP4K4
SCHEMBL4536473 0.84 MAP4K4 (0.49) MAP4K4
SCHEMBL3766368 0.83 PIK3CG (0.49) MAPK8TTKPIK3CAMAPK9MAPK10
SCHEMBL4534848 0.83 MAP4K4 (0.65) MAP4K4DHFR
SCHEMBL4122691 0.83 MAP4K4 (0.55) MAP4K4
SCHEMBL4525197 0.82 ALDH1A1 (0.52) MAP4K4DHFR
SCHEMBL4412814 0.82 MET (0.40) MAP4K4CHEK2
SCHEMBL4101142 0.81 MAP4K4 (0.44) MAP4K4MAPK8PIK3CAMAPK9MAPK10
SCHEMBL823663 0.81 DHFR (0.54) MAP4K4DHFRKDM1A

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
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US claimed
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 MAP4K4 2930/4885MAPK8 3434/4885TTK 2567/4885

“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.