SCHEMBL826099

SCHEMBL826099

CCCCNC(=O)c1ccc(-c2ccc3nc(N)nc(OC(C)(C)CC)c3n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 5/20 0.40
MKNK2 Q9HBH9 5/20 0.40
TLR7 Q9NYK1 5/20 0.39
TLR8 Q9NR97 4/20 0.39
BACE1 P56817 1/20 0.39
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 3/20 0.37
KMT2A Q03164 3/20 0.37
HPGD P15428 2/20 0.37
CASP1 P29466 2/20 0.37
BLM P54132 2/20 0.37
CASP7 P55210 2/20 0.37
HSD17B10 Q99714 2/20 0.37
APAF1 O14727 1/20 0.37
NSD2 O96028 1/20 0.37
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL825764 0.93 MKNK1 (0.41) MKNK1MKNK2TLR7TLR8BACE1
SCHEMBL826328 0.87 HDAC4 (0.40) MKNK1MKNK2TLR7TLR8ALDH1A1
SCHEMBL825895 0.87 MKNK2 (0.34) MKNK1MKNK2TLR7TLR8
SCHEMBL823807 0.87 MKNK1 (0.44) MKNK1MKNK2TLR7TLR8BACE1
SCHEMBL826101 0.87 MAP4K4 (0.38) MKNK1MKNK2ALDH1A1MAPTL3MBTL1
SCHEMBL826435 0.86 MKNK2 (0.43) MKNK1MKNK2BACE1MLYCD
SCHEMBL825927 0.85 MKNK1 (0.43) MKNK1MKNK2NPC1RAB9AKMT2A
SCHEMBL823810 0.85 NAMPT (0.42) MKNK1MKNK2TLR7TLR8BACE1
SCHEMBL825728 0.84 MKNK1 (0.44) MKNK1MKNK2NPC1RAB9AHPGD
SCHEMBL826265 0.83 MKNK1 (0.44) MKNK1MKNK2NPC1RAB9AHPGD

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 3173/4885TLR7 1598/4885

“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.