SCHEMBL823649

SCHEMBL823649

CCOc1nc(N)nc2ccc(-c3ccc(C(=O)NC4CC4)c(Cl)c3)nc12

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
DYRK1A Q13627 11/20 0.43
MELK Q14680 7/20 0.42
MAP4K4 O95819 2/20 0.41
HPGD P15428 1/20 0.40
CHRM4 P08173 1/20 0.39

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
SCHEMBL826356 0.88 IDH1 (0.38) MEN1RAB9AKMT2ADYRK1AMELK
SCHEMBL826252 0.88 HPGD (0.40) RAB9ADYRK1AMELKMAP4K4HPGD
SCHEMBL823772 0.88 MELK (0.43) RAB9ADYRK1AMELKMAP4K4HPGD
SCHEMBL3341799 0.86 RAB9A (0.48) MEN1RAB9AKMT2AMELKMAP4K4
SCHEMBL823680 0.81 MKNK1 (0.49) MEN1RAB9AKMT2AMAP4K4HPGD
SCHEMBL826445 0.78 MKNK1 (0.45) MEN1RAB9AKMT2ADYRK1AMAP4K4
SCHEMBL823823 0.78 RAB9A (0.46) MEN1RAB9AKMT2ADYRK1AHPGD
SCHEMBL825839 0.78 MKNK1 (0.44) MEN1RAB9AKMT2ADYRK1AMAP4K4
SCHEMBL825946 0.78 MKNK1 (0.44) MEN1RAB9AKMT2ADYRK1AMAP4K4
SCHEMBL4525204 0.77 MAP4K4 (0.44) RAB9AMAP4K4

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-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US claimed
US-8143394-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2012-03-27 US disclosed
US-8143394-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2012-03-27 US disclosed
US-8143394-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2012-03-27 US disclosed
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US disclosed
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US disclosed
US-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC (US) 2009-12-31 US disclosed
WO-2008077649-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTONS 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-20090324543-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS PNPO, DPYD, PLPBP MEN1 4807/4885RAB9A 3030/4885KMT2A 2746/4885

“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.