SCHEMBL5758909

SCHEMBL5758909

COc1cccc(O)c1-c1nc2ccc(CN3CCCC3)cc2s1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ILK Q13418 3/20 0.55
SSTR5 P35346 2/20 0.46
HRH3 Q9Y5N1 1/20 0.44
HCRTR1 O43613 3/20 0.43
HCRTR2 O43614 3/20 0.43
GAA P10253 1/20 0.42
APP P05067 4/20 0.41

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
SCHEMBL5759036 0.79 ILK (0.53) ILKSSTR5HRH3GAAAPP
SCHEMBL5756793 0.79 ILK (0.52) ILKSSTR5HRH3
SCHEMBL5756434 0.79 APP (0.55) ILKAPP
SCHEMBL5755215 0.79 MAPK1 (0.52) HCRTR1HCRTR2GAA
SCHEMBL5757642 0.78 APP (0.52) ILKAPP
SCHEMBL5757115 0.77 ILK (0.51) ILKHRH3GAA
SCHEMBL5756078 0.75 KDM4E (0.55) ILKHCRTR1GAA
SCHEMBL5755158 0.74 ILK (0.51) ILKHRH3APP
SCHEMBL5756448 0.73 ILK (0.52) ILKHRH3
SCHEMBL5756935 0.72 ILK (0.51) ILKHRH3GAAAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539723-B1 NOVEL USE OF BENZOTHIAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2006-05-24 EP claimed
US-20060106015-A1 Novel use of benzothiazole derivatives ASTRAZENECA (SE) 2006-05-18 US claimed
EP-1539723-A1 NOVEL USE OF BENZOTHIAZOLE DERIVATIVES AstraZeneca AB (SE) 2005-06-15 EP claimed
WO-2004016600-A1 NOVEL USE OF BENZOTHIAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2004-02-26 WO claimed
EP-1539723-B1 NOVEL USE OF BENZOTHIAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2006-05-24 EP disclosed
US-20060106015-A1 Novel use of benzothiazole derivatives ASTRAZENECA (SE) 2006-05-18 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-20060106015-A1 Novel use of benzothiazole derivatives ITK, WEE2, WEE1 ILK 1798/4885SSTR5 4632/4885HRH3 1992/4885

“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.