SCHEMBL5255277

SCHEMBL5255277

COCCOc1ccc2c(C3C(=O)Nc4ccc(C#N)cc43)nccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.44
ALK Q9UM73 7/20 0.39
DYRK1A Q13627 2/20 0.39
PDGFRB P09619 2/20 0.39
AURKA O14965 1/20 0.39
DAPK3 O43293 1/20 0.39
PRKD3 O94806 1/20 0.39
MAP4K4 O95819 1/20 0.39
CSF1R P07333 1/20 0.39
RET P07949 1/20 0.39
FGFR1 P11362 1/20 0.39
FLT1 P17948 1/20 0.39
LTK P29376 1/20 0.39
GRK5 P34947 1/20 0.39
KDR P35968 1/20 0.39
MAP2K2 P36507 1/20 0.39
FLT3 P36888 1/20 0.39
MAPK8 P45983 1/20 0.39
CSNK1A1 P48729 1/20 0.39
CLK2 P49760 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
SCHEMBL5255729 0.97 CHEK1 (0.43) CHEK1ALKDYRK1APDGFRBAURKA
Trifluoroacetic Acid SCHEMBL5256029 0.91 ALK (0.39) CHEK1ALKDYRK1APDGFRBAURKA
SCHEMBL3942219 0.85 CHEK1 (0.60) CHEK1ALKDYRK1APDGFRBAURKA
SCHEMBL3935762 0.83 CHEK1 (0.58) CHEK1ALKDYRK1APDGFRBAURKA
SCHEMBL6511852 0.80 CHEK1 (0.39) CHEK1ALKDYRK1APDGFRBAURKA
SCHEMBL4518666 0.76 PDGFRB (0.46) CHEK1PDGFRBFGFR1FLT1KDR
Trifluoroacetic Acid SCHEMBL5313639 0.75 AR (0.35) CHEK1ALKDYRK1APDGFRBAURKA
Hydrochloric Acid SCHEMBL7206364 0.75 CHEK1 (0.46) CHEK1PDGFRBFGFR1FLT1KDR
SCHEMBL4680526 0.72 CHEK1 (0.56) CHEK1ALKDYRK1APDGFRBAURKA
SCHEMBL4680520 0.71 CHEK1 (0.55) CHEK1ALKDYRK1APDGFRBAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1458707-B1 New Indol-2-one derivatives ASTRAZENECA AB (SE) 2007-05-02 EP claimed
US-7205314-B2 Compounds for the treatment of dementia related diseases ASTRAZENECA AB (SE) 2007-04-17 US claimed
US-20050065170-A1 associated with the inhibition of glycogen synthase kinase-3, prevention and/or treatment of dementia related disease, Alzheimer's Disease etc.; example: 3-[6-(2-Methoxyethoxy)isoquinolin-1-yl]-2-oxo-2,3-dihydro-1H-indole-5-carbonitrile ASTRAZENECA AB (SE) 2005-03-24 US claimed
EP-1458707-A2 NEW COMPOUNDS AstraZeneca AB (SE) 2004-09-22 EP claimed
WO-2003053330-A2 USE OF OXINDOLE DERIVATIVES IN THE TREATMENT OF DEMENTIA RELATED DISEASES, ALZHEIMER’S DISEASE AND CONDITIONS ASSOCIATED WITH GLYCOGEN SYNTHASE KINASE-3 ASTRAZENECA AB (SE) 2003-07-03 WO claimed
EP-1458707-B1 New Indol-2-one derivatives ASTRAZENECA AB (SE) 2007-05-02 EP disclosed
US-7205314-B2 Compounds for the treatment of dementia related diseases ASTRAZENECA AB (SE) 2007-04-17 US disclosed
US-20050065170-A1 associated with the inhibition of glycogen synthase kinase-3, prevention and/or treatment of dementia related disease, Alzheimer's Disease etc.; example: 3-[6-(2-Methoxyethoxy)isoquinolin-1-yl]-2-oxo-2,3-dihydro-1H-indole-5-carbonitrile ASTRAZENECA AB (SE) 2005-03-24 US disclosed
EP-1458707-A2 NEW COMPOUNDS AstraZeneca AB (SE) 2004-09-22 EP disclosed
WO-2003053330-A2 USE OF OXINDOLE DERIVATIVES IN THE TREATMENT OF DEMENTIA RELATED DISEASES, ALZHEIMER’S DISEASE AND CONDITIONS ASSOCIATED WITH GLYCOGEN SYNTHASE KINASE-3 ASTRAZENECA AB (SE) 2003-07-03 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-20050065170-A1 associated with the inhibition of glycogen synthase kinase-3, prevention and/or treatment of dementia related disease, Alzheimer's Disease etc.; example: 3-[6-(2-Methoxyethoxy)isoquinolin-1-yl]-2-oxo-2,3-dihydro-1H-indole-5-carbonitrile GSK3A, GSK3B, PYGB CHEK1 641/4885ALK 3843/4885DYRK1A 212/4885

“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.