SCHEMBL4238643

SCHEMBL4238643

Cc1nnc(-c2cccnc2C)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
TDO2 P48775 1/20 0.39
VHL P40337 1/20 0.37
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
BTK Q06187 1/20 0.34
PDE2A O00408 5/20 0.34
PDE10A Q9Y233 5/20 0.34
PPARG P37231 1/20 0.34
PDE4D Q08499 2/20 0.33
PDE3A Q14432 2/20 0.33
CDC7 O00311 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE6D O43924 1/20 0.33
PDE6A P16499 1/20 0.33
PDE6G P18545 1/20 0.33
PDE6B P35913 1/20 0.33

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
SCHEMBL16067348 0.77 BTK (0.41) BTKPDE5A
SCHEMBL31469002 0.75 MKNK1 (0.52) MKNK1MKNK2TDO2VHLPDE2A
SCHEMBL3421959 0.75 MKNK1 (0.52) MKNK1MKNK2TDO2VHLPDE2A
SCHEMBL420008 0.75 DCUN1D1 (0.52) PPARGNPY5RKDM4ENPSR1
SCHEMBL16481782 0.73 GAA (0.40) PDE2APDE10AL3MBTL1
SCHEMBL16380549 0.73 MKNK1 (0.38) MKNK1MKNK2TDO2VHLPRMT5
SCHEMBL416830 0.72 MGAM (0.49) KDM4EPOLB
SCHEMBL3600525 0.72 NISCH (0.48) MKNK1MKNK2TDO2VHLKDM4E
SCHEMBL420934 0.72 KDM4E (0.54) BTKNPY5RKDM4EPOLBL3MBTL1
SCHEMBL415342 0.69 KDM4E (0.46) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036461-A1 Use of Azabicyclo Hexane Derivatives GLAXO GROUP LIMITED (GB) 2009-02-05 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-20090036461-A1 Use of Azabicyclo Hexane Derivatives ADH1C, PKD1, HTT MKNK1 4022/4885MKNK2 4264/4885TDO2 975/4885

“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.