SCHEMBL5256175

SCHEMBL5256175

COCCOCCOc1ccc2c(=O)[nH]ccc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 1/20 0.48
ROCK1 Q13464 12/20 0.46
ROCK2 O75116 2/20 0.46
PRKCD Q05655 2/20 0.46
PRKACA P17612 1/20 0.46
PRKG1 Q13976 1/20 0.46
PKN1 Q16512 1/20 0.46
PKN2 Q16513 1/20 0.46
AAK1 Q2M2I8 1/20 0.46
CDC42BPA Q5VT25 1/20 0.46
Q6ZSR9 Q6ZSR9 1/20 0.46
BMP2K Q9NSY1 1/20 0.46
CDC42BPB Q9Y5S2 1/20 0.46
APP P05067 2/20 0.45
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PRKX P51817 1/20 0.43
PRKCE Q02156 1/20 0.43
PRKD1 Q15139 1/20 0.43

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
SCHEMBL1038440 0.80 MAP2K1 (0.52) MAP2K1ROCK1ROCK2PRKCDPRKACA
SCHEMBL745351 0.80 MAP2K1 (0.54) MAP2K1ROCK1ROCK2PRKCDPRKACA
SCHEMBL374997 0.78 ROCK1 (0.56) MAP2K1ROCK1ROCK2PRKCDPRKACA
SCHEMBL4497910 0.77 PARP1 (0.51) APPMAOADYRK1APARP1
SCHEMBL17489612 0.76 MAOA (0.53) APPKDM4EMAPK1TDP1MAOA
SCHEMBL1196073 0.75 LTA4H (0.58) APPMAPK1MAOADYRK1A
SCHEMBL14861588 0.74 CCNK (0.39) APPMAPK1
SCHEMBL13423105 0.74 MAP2K1 (0.64) MAP2K1ROCK1ROCK2PRKCDPRKACA
SCHEMBL9983791 0.73 MAPK1 (0.66) APPKDM4EMAPK1TDP1MAOA
SCHEMBL30041284 0.73 MAPK1 (0.66) APPKDM4EMAPK1TDP1MAOA

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
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 MAP2K1 919/4885ROCK1 148/4885ROCK2 247/4885

“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.