SCHEMBL5108593

SCHEMBL5108593

CCOc1nc(NCc2ccc(F)cc2)nc2ccc(-c3ccc(NC(=O)NCCN4CCOCC4)cc3)nc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
AURKB Q96GD4 2/20 0.48
ABL1 P00519 1/20 0.46
EPHX2 P34913 1/20 0.46
KDR P35968 1/20 0.45
FLT3 P36888 1/20 0.45
PDE5A O76074 2/20 0.43
TSHR P16473 1/20 0.43
MAPT P10636 2/20 0.43
CNR1 P21554 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KCNH2 Q12809 3/20 0.42
MAP4K4 O95819 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
HTR4 Q13639 1/20 0.42
NAMPT P43490 1/20 0.42
MET P08581 1/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL5108387 0.94 ADRA2A (0.49) LMNAAURKBABL1MAPTCNR1
SCHEMBL5108106 0.90 MTOR (0.47) ABL1KDRNAMPT
SCHEMBL14131625 0.87 SMN1; SMN2 (0.47) AURKBMAPTSMN1; SMN2CYP2C9
SCHEMBL5120890 0.84 CA2 (0.46) MAPTNAMPT
SCHEMBL5108650 0.82 CTNNB1 (0.43) LMNAAURKBMAPTSMN1; SMN2KCNH2
SCHEMBL14131742 0.81 HDAC1 (0.44) MAPTSMN1; SMN2CYP3A4CYP2C9
SCHEMBL5114918 0.81 RECQL (0.42) EPHX2
SCHEMBL5110248 0.81 CTNNB1 (0.41) AURKBABL1FLT3MAPTKCNH2
SCHEMBL5121639 0.80 MAP4K4 (0.43) LMNAAURKBPDE5AMAPTMAP4K4
SCHEMBL5116329 0.80 CTNNB1 (0.41) AURKBABL1FLT3MAPTMET

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 LMNA 879/4885AURKB 2316/4885ABL1 1081/4885

“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.