SCHEMBL5115983

SCHEMBL5115983

CCOP(=O)(CCNc1nc(NCC(F)(F)F)c2nc(-c3ccc(F)cc3)ccc2n1)OCC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 3/20 0.37
TLR7 Q9NYK1 3/20 0.37
NPY5R Q15761 1/20 0.33
SYK P43405 2/20 0.33
AURKB Q96GD4 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
CSNK1D P48730 1/20 0.33
MAPK14 Q16539 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAP4K4 O95819 1/20 0.32
PAK4 O96013 1/20 0.32
MAPK8 P45983 1/20 0.32
TYRO3 Q06418 1/20 0.32
LRRK2 Q5S007 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL5111443 0.84 KCNH3 (0.45) TLR8TLR7SYKAURKBALDH1A1
SCHEMBL5115991 0.84 NPR1 (0.32) TLR8TLR7SYKAURKBMAP4K4
SCHEMBL5122262 0.82 TP53 (0.38) TLR8TLR7SYKAURKBALDH1A1
SCHEMBL14140290 0.79 SYK (0.36) TLR8TLR7SYKAURKBALDH1A1
SCHEMBL5112291 0.78 SYK (0.36) TLR8TLR7SYKAURKBALDH1A1
SCHEMBL5114013 0.78 LIPC (0.36) TLR8TLR7SYKAURKBPDE5A
SCHEMBL5115971 0.78 MAPT (0.46) TLR8TLR7ALDH1A1KDM4ELMNA
SCHEMBL5112172 0.74 MAPT (0.35) SYKAURKBALDH1A1KDM4ECSNK1D
SCHEMBL5114989 0.74 MAP4K4 (0.44) TLR8TLR7SYKAURKBMAP4K4
SCHEMBL15698681 0.74 TP53 (0.42) TLR8TLR7KDM4ECYP3A4HSD17B10

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US disclosed
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US disclosed
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US disclosed
US-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-31 US disclosed
US-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-31 US disclosed
US-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-31 US disclosed
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS 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-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS PNPO, DPYD, PNP TLR8 2289/4885TLR7 964/4885NPY5R 1086/4885

“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.