SCHEMBL825615

SCHEMBL825615

CCC(=O)Nc1ccc(-c2ccc3nc(N)nc(NCCCOC)c3n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 18/20 0.45
TLR7 Q9NYK1 18/20 0.45
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL823694 0.94 TLR8 (0.49) TLR8TLR7NPC1RAB9ASMN1; SMN2
SCHEMBL826475 0.92 TLR8 (0.42) TLR8TLR7NPC1RAB9ASMN1; SMN2
SCHEMBL826432 0.90 TLR7 (0.45) TLR8TLR7
SCHEMBL826042 0.88 TLR8 (0.45) TLR8TLR7
SCHEMBL826031 0.88 GHSR (0.41) TLR8TLR7NPC1RAB9ASMN1; SMN2
SCHEMBL826093 0.87 TLR8 (0.41) TLR8TLR7NPC1RAB9ASMN1; SMN2
SCHEMBL826887 0.87 TLR8 (0.41) TLR8TLR7NPC1RAB9ASMN1; SMN2
SCHEMBL825654 0.86 MAPT (0.39) TLR8TLR7NPC1RAB9ASMN1; SMN2
SCHEMBL823723 0.85 NPC1 (0.41) TLR8TLR7NPC1RAB9ASMN1; SMN2
SCHEMBL823630 0.84 TLR7 (0.51) TLR8TLR7

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 1598/4885NPC1 3135/4885

“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.