SCHEMBL826475

SCHEMBL826475

CCOCCCNc1nc(N)nc2ccc(-c3ccc(NC(=O)CC)cc3)nc12

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 17/20 0.42
TLR7 Q9NYK1 17/20 0.42
GHSR Q92847 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL826031 0.94 GHSR (0.41) TLR8TLR7GHSRNPC1RAB9A
SCHEMBL825615 0.92 TLR8 (0.45) TLR8TLR7NPC1RAB9ASMN1; SMN2
SCHEMBL826113 0.91 TLR8 (0.44) TLR8TLR7
SCHEMBL826210 0.89 TLR8 (0.43) TLR8TLR7
SCHEMBL826093 0.88 TLR8 (0.41) TLR8TLR7GHSRNPC1RAB9A
SCHEMBL823694 0.88 TLR8 (0.49) TLR8TLR7GHSRNPC1RAB9A
SCHEMBL826887 0.86 TLR8 (0.41) TLR8TLR7GHSRNPC1RAB9A
SCHEMBL825654 0.85 MAPT (0.39) TLR8TLR7GHSRNPC1RAB9A
SCHEMBL825736 0.85 CCNB2 (0.42) TLR8TLR7
SCHEMBL825739 0.85 GHSR (0.41) GHSRNPC1RAB9ASMN1; SMN2KDM4E

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 TLR8 2236/4885TLR7 1598/4885GHSR 4810/4885

“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.