SCHEMBL1010871

SCHEMBL1010871

CCOc1ccc(F)c(Oc2cnn(C(CC3CCOCC3)C(=O)O)c(=O)c2)c1F

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.36
GCK P35557 9/20 0.35
F11 P03951 1/20 0.32
KLKB1 P03952 1/20 0.32
PDE9A O76083 1/20 0.32
P2RX3 P56373 1/20 0.32
TTK P33981 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
DGAT2 Q96PD7 2/20 0.32

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
SCHEMBL1008521 0.85 GCK (0.38) GCKPDE9A
SCHEMBL1008661 0.83 PTGDR2 (0.35) BRD4P2RX3
SCHEMBL1058444 0.82 GCK (0.41) GCKIRAK4
SCHEMBL1058443 0.82 GCK (0.41) GCKIRAK4
SCHEMBL1009234 0.80 LPAR1 (0.34) GCK
SCHEMBL4290756 0.80 GCK (0.38) GCKP2RX3
SCHEMBL4290753 0.80 GCK (0.38) GCKP2RX3
SCHEMBL1008514 0.77 LPAR1 (0.38)
SCHEMBL1007597 0.77 LPAR1 (0.38)
SCHEMBL1008391 0.76 LPAR1 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8258134-B2 Pyridazinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US disclosed
US-8258134-B2 Pyridazinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US disclosed
US-8258134-B2 Pyridazinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-09-04 US disclosed
EP-2268633-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2011-01-05 EP disclosed
US-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US disclosed
US-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US disclosed
US-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US disclosed
WO-2009127544-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2009-10-22 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-20090264434-A1 PYRIDAZINONE GLUCOKINASE ACTIVATORS GCK, GCKR, PDXK BRD4 2518/4885GCK 1/4885F11 3352/4885

“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.