SCHEMBL1960133

SCHEMBL1960133

CC(C)(O)c1ccc(/C(=C/C2CCCC2)c2cc3cc(F)cnc3[nH]2)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GCK P35557 5/20 0.47
GSK3A P49840 2/20 0.38
PIK3CA P42336 1/20 0.38
MTOR P42345 1/20 0.38
MAP3K5 Q99683 2/20 0.33
SNCA P37840 1/20 0.33
GSK3B P49841 1/20 0.33
TNKS O95271 4/20 0.32
PARP1 P09874 4/20 0.32
TNKS2 Q9H2K2 4/20 0.32
PARP2 Q9UGN5 1/20 0.32
PARP3 Q9Y6F1 1/20 0.32
ULK1 O75385 1/20 0.31
NTRK1 P04629 1/20 0.31
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30

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
SCHEMBL1960134 1.00 GCK (0.47) GCKGSK3APIK3CAMTORMAP3K5
SCHEMBL1961999 0.87 GCK (0.49) GCKMTORULK1NTRK1JAK2
SCHEMBL1961997 0.87 GCK (0.49) GCKMTORULK1NTRK1JAK2
SCHEMBL1959849 0.86 GCK (0.51) GCKGSK3APIK3CAMTORMAP3K5
SCHEMBL1959848 0.86 GCK (0.51) GCKGSK3APIK3CAMTORMAP3K5
SCHEMBL1962003 0.84 GCK (0.65) GCK
SCHEMBL1962005 0.84 GCK (0.65) GCK
SCHEMBL1958734 0.83 GCK (0.54) GCK
SCHEMBL1958737 0.83 GCK (0.54) GCK
SCHEMBL1958735 0.83 GCK (0.54) GCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513103-A1 AZAINDOLE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2012-10-24 EP disclosed
US-8222416-B2 Azaindole glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-07-17 US disclosed
WO-2011073117-A1 AZAINDOLE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2011-06-23 WO disclosed
US-20110144105-A1 AZAINDOLE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2011-06-16 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-20110144105-A1 AZAINDOLE GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 GCK 1/4885GSK3A 1553/4885PIK3CA 1638/4885

“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.