SCHEMBL4110941

SCHEMBL4110941

COc1ccc(-c2cc(-c3cc4c(=O)[nH]cnc4[nH]3)ccn2)cc1F

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 14/20 0.74
MAPK9 P45984 4/20 0.44
AURKA O14965 2/20 0.44
JAK2 O60674 2/20 0.44
LCK P06239 2/20 0.44
MET P08581 2/20 0.44
KIT P10721 2/20 0.44
MAPK1 P28482 2/20 0.44
KDR P35968 2/20 0.44
SYK P43405 2/20 0.44
MAPK8 P45983 2/20 0.44
GSK3B P49841 2/20 0.44
JAK3 P52333 2/20 0.44
EPHB4 P54760 2/20 0.44
PDK1 Q15118 2/20 0.44
MAPKAPK5 Q8IW41 2/20 0.44
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
INSR P06213 1/20 0.44
IGF1R P08069 1/20 0.44

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
SCHEMBL4111025 0.83 MAPKAPK2 (1.00) MAPKAPK2MAPK9AURKAJAK2LCK
SCHEMBL4106225 0.83 MAPKAPK2 (0.77) MAPKAPK2MAPK9AURKAJAK2LCK
SCHEMBL4099265 0.79 MAPKAPK2 (1.00) MAPKAPK2MAPK9AURKAJAK2LCK
SCHEMBL4116711 0.75 MAPKAPK2 (0.76) MAPKAPK2MAPK9AURKAJAK2LCK
SCHEMBL4116753 0.74 MAPKAPK2 (0.62) MAPKAPK2MAPK9AURKAJAK2LCK
SCHEMBL4111093 0.73 MAPKAPK2 (0.71) MAPKAPK2MAPK9AURKAJAK2LCK
SCHEMBL3994801 0.73 ALDH1A1 (0.51) METKITMAPK1KDRMEN1
SCHEMBL18342008 0.73 MAPKAPK2 (0.76) MAPKAPK2KITGSK3BPIM1PIM2
SCHEMBL4110397 0.72 MAPKAPK2 (0.64) MAPKAPK2MAPK9AURKAJAK2LCK
SCHEMBL4112040 0.72 MAPKAPK2 (0.76) MAPKAPK2MAPK9AURKAJAK2LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090169558-A1 BICYCLIC AROMATIC COMPOUNDS USEFUL AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 NOVARTIS AG 2009-07-02 US claimed
EP-1934223-A1 BICYCLIC AROMATIC COMPOUNDS USEFUL AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 Novartis Pharma AG (CH) 2008-06-25 EP claimed
WO-2007039285-A1 BICYCLIC AROMATIC COMPOUNDS USEFUL AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 NOVARTIS AG (CH) 2007-04-12 WO claimed
US-20090169558-A1 BICYCLIC AROMATIC COMPOUNDS USEFUL AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 NOVARTIS AG 2009-07-02 US disclosed
US-20090169558-A1 BICYCLIC AROMATIC COMPOUNDS USEFUL AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 NOVARTIS AG 2009-07-02 US disclosed
US-20090169558-A1 BICYCLIC AROMATIC COMPOUNDS USEFUL AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 NOVARTIS AG 2009-07-02 US disclosed
EP-1934223-A1 BICYCLIC AROMATIC COMPOUNDS USEFUL AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 Novartis Pharma AG (CH) 2008-06-25 EP disclosed
WO-2007039285-A1 BICYCLIC AROMATIC COMPOUNDS USEFUL AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 NOVARTIS AG (CH) 2007-04-12 WO disclosed
WO-2007039285-A1 BICYCLIC AROMATIC COMPOUNDS USEFUL AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 NOVARTIS AG (CH) 2007-04-12 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-20090169558-A1 BICYCLIC AROMATIC COMPOUNDS USEFUL AS INHIBITORS OF MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 MAP4K2, MAPKAPK2, MAP3K2 MAPKAPK2 2/4885MAPK9 32/4885AURKA 129/4885

“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.