SCHEMBL1793167

SCHEMBL1793167

CC1(Oc2nc(NCc3ccc(-n4cncn4)cc3)nc3ccc(-c4ccc(OC5CC5)nc4)nc23)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 15/20 0.43
FLT3 P36888 3/20 0.43
PIK3CD O00329 3/20 0.43
NTRK1 P04629 2/20 0.43
IRAK1 P51617 2/20 0.43
NTRK3 Q16288 2/20 0.43
NTRK2 Q16620 2/20 0.43
BTK Q06187 1/20 0.43
CYP11B2 P19099 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
DGAT1 O75907 2/20 0.31
KCNH2 Q12809 2/20 0.31
SOAT1 P35610 1/20 0.31
ADORA2A P29274 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
SCHEMBL1792506 0.97 IRAK4 (0.42) IRAK4FLT3PIK3CDNTRK1IRAK1
SCHEMBL1792420 0.91 IRAK4 (0.46) IRAK4FLT3PIK3CDNTRK1IRAK1
SCHEMBL1794377 0.91 DGAT1 (0.35) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL1790789 0.89 DGAT1 (0.34) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL1790640 0.85 DGAT1 (0.33) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL1791750 0.84 IRAK4 (0.43) IRAK4FLT3PIK3CDNTRK1IRAK1
SCHEMBL1794686 0.83 DGAT1 (0.37) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL1789379 0.82 IRAK4 (0.33) IRAK4FLT3PIK3CDNTRK1IRAK1
SCHEMBL1792727 0.81 DGAT1 (0.35) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL1792377 0.81 IRAK4 (0.43) IRAK4FLT3PIK3CDNTRK1IRAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8536187-B2 2,4,6-trisubstituted pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2013-09-17 US claimed
US-20110123493-A1 2,4,6-TRISUBSTITUTED PYRIDO(3,2-d) PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2011-05-26 US claimed
US-8536187-B2 2,4,6-trisubstituted pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2013-09-17 US disclosed
US-8536187-B2 2,4,6-trisubstituted pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2013-09-17 US disclosed
US-8536187-B2 2,4,6-trisubstituted pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2013-09-17 US disclosed
US-20110123493-A1 2,4,6-TRISUBSTITUTED PYRIDO(3,2-d) PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2011-05-26 US disclosed
US-20110123493-A1 2,4,6-TRISUBSTITUTED PYRIDO(3,2-d) PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2011-05-26 US disclosed
US-20110123493-A1 2,4,6-TRISUBSTITUTED PYRIDO(3,2-d) PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2011-05-26 US 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-20110123493-A1 2,4,6-TRISUBSTITUTED PYRIDO(3,2-d) PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS PNPO, CYP2S1, DPYD IRAK4 1550/4885FLT3 1158/4885PIK3CD 2424/4885

“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.