SCHEMBL4698769

SCHEMBL4698769

Nc1ccc2ncc(-c3ccc(O)cc3)nc2n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.54
PIK3CG P48736 2/20 0.54
MAPK1 P28482 8/20 0.51
PIK3CA P42336 6/20 0.51
MAPK8 P45983 4/20 0.51
MAPK9 P45984 4/20 0.51
MAPK10 P53779 4/20 0.51
RIPK1 Q13546 1/20 0.45
AKR1B1 P15121 1/20 0.42
LTA4H P09960 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
ESR2 Q92731 2/20 0.40
PRKDC P78527 1/20 0.40
ATM Q13315 1/20 0.40
ATR Q13535 1/20 0.40
ESR1 P03372 1/20 0.40
TLR9 Q9NR96 1/20 0.40
ALDH1A1 P00352 1/20 0.39
POLB P06746 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
SCHEMBL4676928 0.83 TLR9 (0.57) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL13083328 0.78 SMN1; SMN2 (0.46) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL17030247 0.76 MAPK1 (0.42) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL9908948 0.75 BCHE (0.65) BCHEPIK3CGMAPK1PIK3CAMAPK8
SCHEMBL13083333 0.75 MAPK1 (0.53) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL19480349 0.75 KDM4E (0.47) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL3740970 0.75 PIK3CG (0.50) PIK3CGLTA4HMKNK1MKNK2ESR2
SCHEMBL31663159 0.74 PLAU (0.40) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL3638905 0.74 PLAU (0.40) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL28185930 0.74 TLR9 (0.71) BCHEPIK3CGMAPK1PIK3CAMAPK8

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-20130157976-A1 NOVEL PYRIDOPYRAZINES AND THEIR USE AS MODULATORS OF KINASES CLAUS ECKHARD (DE) 2013-06-20 US disclosed
US-20120252760-A1 NOVEL PYRIDOPYRAZINES AND THEIR USE AS MODULATORS OF KINASES ZENTARIS GMBH (DE) 2012-10-04 US disclosed
US-8217042-B2 Pyridopyrazines and their use as modulators of kinases ZENTARIS GMBH (DE) 2012-07-10 US disclosed
EP-1957487-A1 NOVEL PYRIDOPYRAZINES AND THEIR USE AS MODULATORS OF KINASES AEterna Zentaris GmbH (DE) 2008-08-20 EP disclosed
US-20070149484-A1 NOVEL PYRIDOPYRAZINES AND THEIR USE AS MODULATORS OF KINASES ZENTARIS GMBH (DE) 2007-06-28 US disclosed
WO-2007054556-A1 NOVEL PYRIDOPYRAZINES AND THEIR USE AS MODULATORS OF KINASES ÆTERNA ZENTARIS GMBH (DE) 2007-05-18 WO disclosed
EP-1785423-A1 Pyridopyrazine derivatives and their use as kinase modulators Zentaris GmbH (DE) 2007-05-16 EP 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 (3 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-20070149484-A1 NOVEL PYRIDOPYRAZINES AND THEIR USE AS MODULATORS OF KINASES MAP4K2, MAP3K15, MAP3K5 BCHE 4432/4885PIK3CG 392/4885MAPK1 47/4885
US-20120252760-A1 NOVEL PYRIDOPYRAZINES AND THEIR USE AS MODULATORS OF KINASES MAP4K2, MAP3K15, MAP3K5 BCHE 4432/4885PIK3CG 392/4885MAPK1 47/4885
US-20130157976-A1 NOVEL PYRIDOPYRAZINES AND THEIR USE AS MODULATORS OF KINASES MAP4K2, MAP3K15, MAP3K5 BCHE 4432/4885PIK3CG 392/4885MAPK1 47/4885

“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.