SCHEMBL5116366

SCHEMBL5116366

CCOc1nc(NCc2c(F)cc(F)cc2F)nc2ccc(-c3ccc(F)cc3)nc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 6/20 0.36
MAPT P10636 3/20 0.34
SGK1 O00141 1/20 0.33
TP53 P04637 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RXFP1 Q9HBX9 2/20 0.32
TRPV3 Q8NET8 2/20 0.32
PTGS2 P35354 2/20 0.32
PTGS1 P23219 1/20 0.32
ADORA2A P29274 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CG P48736 1/20 0.32
EGFR P00533 1/20 0.32
ERBB2 P04626 1/20 0.32
AURKA O14965 1/20 0.32
ABL1 P00519 1/20 0.32
NTRK1 P04629 1/20 0.32
LCK P06239 1/20 0.32
CSF1R P07333 1/20 0.32

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
SCHEMBL5111832 0.93 MAPT (0.36) MAP4K4MAPTSGK1TP53SMN1; SMN2
SCHEMBL5123178 0.92 MAPT (0.40) MAP4K4MAPTSGK1TP53SMN1; SMN2
SCHEMBL5116006 0.88 GAA (0.43) MAP4K4NTRK1NTRK3
SCHEMBL5115353 0.88 MAP4K4 (0.40) MAP4K4MAPTTP53SMN1; SMN2PTGS2
SCHEMBL5123850 0.87 MAPT (0.43) MAPTTP53SMN1; SMN2PTGS2PTGS1
SCHEMBL4573278 0.87 MAP4K4 (0.42) MAP4K4MAPTSMN1; SMN2RXFP1MET
SCHEMBL5121955 0.86 MAPT (0.38) MAP4K4MAPTSGK1TP53SMN1; SMN2
SCHEMBL5111887 0.85 MAPT (0.39) MAP4K4MAPTSGK1TP53SMN1; SMN2
SCHEMBL4573181 0.84 MERTK (0.37) MAP4K4PTGS2MAPK14CNR2
SCHEMBL4573442 0.84 TP53 (0.47) MAPTTP53SMN1; SMN2PTGS2ADORA2A

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 MAP4K4 1899/4885MAPT 3290/4885SGK1 4702/4885

“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.