SCHEMBL826358

SCHEMBL826358

CC(C)(C)Oc1nc(N)nc2ccc(-c3ccc(C(=O)NC4CC4)cc3)nc12

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 2/20 0.45
MKNK2 Q9HBH9 2/20 0.45
MAP4K4 O95819 3/20 0.42
MAPK14 Q16539 3/20 0.41
ATR Q13535 3/20 0.41
SMYD3 Q9H7B4 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HDAC4 P56524 2/20 0.39
TTK P33981 1/20 0.39
HPGDS O60760 2/20 0.38
FYN P06241 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
SCHEMBL825655 0.96 MKNK1 (0.47) MKNK1MKNK2MAP4K4MAPK14ATR
SCHEMBL825712 0.95 MKNK1 (0.46) MKNK1MKNK2MAP4K4ATRNPC1
SCHEMBL825927 0.91 MKNK1 (0.43) MKNK1MKNK2MAP4K4MAPK14ATR
SCHEMBL823731 0.89 MKNK1 (0.47) MKNK1MKNK2MAP4K4MAPK14ATR
SCHEMBL825728 0.87 MKNK1 (0.44) MKNK1MKNK2MAP4K4NPC1RAB9A
SCHEMBL826265 0.86 MKNK1 (0.44) MKNK1MKNK2MAP4K4NPC1RAB9A
SCHEMBL823813 0.86 MKNK1 (0.45) MKNK1MKNK2MAP4K4MAPK14ATR
SCHEMBL826277 0.85 JAK2 (0.39) MKNK1MKNK2MAP4K4HPGDS
SCHEMBL826145 0.85 MKNK2 (0.36) MKNK1MKNK2MAP4K4MAPK14MEN1
SCHEMBL826252 0.85 HPGD (0.40) MAP4K4NPC1RAB9ATTK

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 MKNK1 3271/4885MKNK2 3173/4885MAP4K4 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.