SCHEMBL2386232

SCHEMBL2386232

Nc1ncc(Br)cc1-c1nc2cnccc2o1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 10/20 0.54
MAPT P10636 4/20 0.43
XBP1 P17861 1/20 0.43
HIF1A Q16665 1/20 0.43
TP53 P04637 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
PIK3CB P42338 2/20 0.40
PIK3CA P42336 1/20 0.37
KMT2A Q03164 3/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 3/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
KCNH2 Q12809 2/20 0.36
GRK2 P25098 1/20 0.36
GRK5 P34947 1/20 0.36
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35

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
SCHEMBL2386970 0.89 MET (0.54) METMAPTXBP1HIF1ATP53
SCHEMBL12256971 0.84 MET (0.54) METMAPTTP53SMN1; SMN2PIK3CB
SCHEMBL2384707 0.83 MET (0.63) METMAPTXBP1HIF1ATP53
SCHEMBL2386346 0.80 MAPT (0.48) METMAPTXBP1HIF1ATP53
SCHEMBL1802082 0.79 MET (0.42) METMAPTTP53SMN1; SMN2PIK3CB
SCHEMBL2387025 0.77 MET (0.61) METTP53SMN1; SMN2HSD17B10KDM4E
SCHEMBL2386008 0.76 NPC1 (0.56) METMAPTTP53SMN1; SMN2HSD17B10
SCHEMBL2387852 0.76 MET (0.45) METMAPTXBP1HIF1ATP53
SCHEMBL21388508 0.75 MET (0.75) METKCNH2GRK2GRK5
SCHEMBL2386483 0.75 CHEK2 (0.62) MET

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-8017611-B2 Pyridine and pyrazine derivatives -083 ASTRAZENECA AB (SE) 2011-09-13 US disclosed
EP-2215085-B1 PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2011-09-07 EP disclosed
EP-2215085-A2 PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS AstraZeneca AB (SE) 2010-08-11 EP disclosed
US-20090118305-A1 PYRIDINE AND PYRAZINE DERIVATIVES - 083 ASTRAZENECA AB (SE) 2009-05-07 US disclosed
WO-2009053737-A2 PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2009-04-30 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-20090118305-A1 PYRIDINE AND PYRAZINE DERIVATIVES - 083 MKI67, CCND3, CCND1 MET 2362/4885MAPT 2946/4885XBP1 2827/4885

“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.