SCHEMBL1800565

SCHEMBL1800565

Nc1ncc(Br)nc1C(=O)Nc1cnccc1O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATR Q13535 13/20 0.58
GRM5 P41594 1/20 0.57
PIM1 P11309 3/20 0.46
PIM3 Q86V86 3/20 0.46
PIM2 Q9P1W9 3/20 0.46
PRKDC P78527 1/20 0.45
CYP3A4 P08684 1/20 0.44
GSK3B P49841 2/20 0.44
DYRK1A Q13627 2/20 0.44
PRKCA P17252 1/20 0.44
PRKCQ Q04759 1/20 0.44
PRKCI P41743 1/20 0.43

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
SCHEMBL12620983 0.86 GRM5 (0.58) ATRGRM5PIM1PIM3PIM2
SCHEMBL1802383 0.83 PIM1 (0.62) ATRGRM5PIM1PIM3PIM2
SCHEMBL14059993 0.81 ATR (0.76) ATRGRM5PRKDCCYP3A4PRKCI
SCHEMBL31387927 0.81 ATR (0.76) ATRGRM5PRKDCCYP3A4PRKCI
SCHEMBL6035375 0.80 GSK3B (0.60) ATRGRM5PIM1PIM3PIM2
SCHEMBL11906844 0.79 PIM2 (0.76) ATRPIM1PIM3PIM2GSK3B
SCHEMBL411951 0.77 ATR (0.75) ATRGRM5PRKDCCYP3A4GSK3B
SCHEMBL11909197 0.77 GRM5 (0.50) ATRGRM5PIM1PIM3PIM2
SCHEMBL20581634 0.77 PIM2 (0.61) ATRPIM1PIM3PIM2CYP3A4
SCHEMBL6035019 0.77 GSK3B (0.61) ATRGRM5PIM1PIM3PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118275-A1 OXAZOLO[4,5-c]PYRIDINE SUBSTITUTED PYRAZINE ASTRAZENECA AB (SE) 2011-05-19 US disclosed
US-20110118275-A1 OXAZOLO[4,5-c]PYRIDINE SUBSTITUTED PYRAZINE ASTRAZENECA AB (SE) 2011-05-19 US disclosed
WO-2011059388-A1 OXAZOLO[4,5-C]PYRIDINE SUBSTITUTED PYRAZINE ASTRAZENECA AB (SE) 2011-05-19 WO disclosed
WO-2011059388-A1 OXAZOLO[4,5-C]PYRIDINE SUBSTITUTED PYRAZINE ASTRAZENECA AB (SE) 2011-05-19 WO disclosed
US-20110118275-A1 OXAZOLO[4,5-c]PYRIDINE SUBSTITUTED PYRAZINE ASTRAZENECA AB (SE) 2011-05-19 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-20110118275-A1 OXAZOLO[4,5-c]PYRIDINE SUBSTITUTED PYRAZINE OXA1L, MC2R, CYP3A5 ATR 2235/4885GRM5 68/4885PIM1 2126/4885

“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.