SCHEMBL5756092

SCHEMBL5756092

COc1ccc(-c2nc3ccc(C(=O)N(C)C)cc3s2)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SULT1A1 P50225 1/20 0.50
DYRK1A Q13627 1/20 0.48
APP P05067 5/20 0.48
GLA P06280 1/20 0.48
GAA P10253 1/20 0.48
HSD17B1 P14061 1/20 0.47
HSD17B2 P37059 1/20 0.47
ALK Q9UM73 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
MEN1 O00255 1/20 0.46
SCD O00767 1/20 0.46
KMT2A Q03164 1/20 0.46
MGAM O43451 1/20 0.46

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
SCHEMBL5754836 0.88 KDM4E (0.54) SULT1A1APPGAAHSD17B1HSD17B2
SCHEMBL5757275 0.88 SULT1A1 (0.47) SULT1A1APPHSD17B1HSD17B2ALK
SCHEMBL5757288 0.84 CA2 (0.58) SULT1A1DYRK1AAPPGLAGAA
SCHEMBL5759668 0.83 KDM4E (0.51) APPGAAHSD17B1HSD17B2NPC1
SCHEMBL5755318 0.81 MAPK1 (0.60) APPGAANPC1RAB9AMEN1
SCHEMBL5756169 0.80 KDM4E (0.53) SULT1A1APPGAAHSD17B1HSD17B2
SCHEMBL5755017 0.79 NPC1 (0.47) SULT1A1APPNPC1RAB9AMEN1
SCHEMBL5754226 0.78 SULT1A1 (0.48) SULT1A1DYRK1AAPPGLAGAA
SCHEMBL5981201 0.76 MAPT (0.71) SULT1A1APPGLAGAANPC1
SCHEMBL4287939 0.76 APP (0.67) SULT1A1APPGLAGAAALK

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-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
EP-1539723-A1 NOVEL USE OF BENZOTHIAZOLE DERIVATIVES AstraZeneca AB (SE) 2005-06-15 EP disclosed
WO-2004016600-A1 NOVEL USE OF BENZOTHIAZOLE DERIVATIVES ASTRAZENECA AB (SE) 2004-02-26 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-20060106015-A1 Novel use of benzothiazole derivatives ITK, WEE2, WEE1 SULT1A1 765/4885DYRK1A 444/4885APP 3980/4885

“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.