SCHEMBL5116771

SCHEMBL5116771

CCOc1nc(NCc2ccc(F)cc2F)nc2ccc(-c3ccc(C(=O)NC4CC4)cc3)nc12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.39
CTNNB1 P35222 2/20 0.39
TCF7L2 Q9NQB0 2/20 0.39
MEN1 O00255 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
MCHR1 Q99705 3/20 0.38
NTRK1 P04629 1/20 0.38
HPGD P15428 1/20 0.37
TTK P33981 1/20 0.37
NPR1 P16066 2/20 0.37
SSTR5 P35346 3/20 0.37
ADRA2A P08913 1/20 0.37
MAP4K4 O95819 1/20 0.36
MAPK14 Q16539 1/20 0.36

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
SCHEMBL5107465 0.89 CTNNB1 (0.47) NAMPTCTNNB1TCF7L2MKNK1MKNK2
SCHEMBL5116006 0.85 GAA (0.43) NTRK1MAP4K4
SCHEMBL5122180 0.79 CA1 (0.46) MKNK1MKNK2HPGDTTK
SCHEMBL5116226 0.79 NTRK1 (0.42) MEN1KMT2ANTRK1HPGD
SCHEMBL5114918 0.77 RECQL (0.42) CTNNB1TCF7L2RAB9A
SCHEMBL5116297 0.77 ARNT (0.39) MEN1KMT2ANTRK1MAP4K4
SCHEMBL3334259 0.76 CTNNB1 (0.53) CTNNB1TCF7L2MCHR1NPR1SSTR5
SCHEMBL5115933 0.76 SGK1 (0.34) MEN1RAB9AKMT2ANTRK1HPGD
SCHEMBL5116366 0.75 MAP4K4 (0.36) NTRK1MAP4K4MAPK14
SCHEMBL823680 0.75 MKNK1 (0.49) MEN1RAB9AKMT2AMKNK1MKNK2

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 NAMPT 106/4885CTNNB1 1384/4885TCF7L2 3616/4885

“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.