SCHEMBL1007983

SCHEMBL1007983

O=C(O)C(CC1CCCC1)n1ncc(Oc2ncccc2F)cc1=O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 9/20 0.39
BACE1 P56817 4/20 0.36
BACE2 Q9Y5Z0 4/20 0.36
FFAR4 Q5NUL3 3/20 0.35
GPR132 Q9UNW8 1/20 0.35
PPARG P37231 1/20 0.35
GCK P35557 1/20 0.34
CCR5 P51681 1/20 0.34

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
SCHEMBL1009610 0.91 P2RX3 (0.43) P2RX3BACE1BACE2GCK
SCHEMBL1008514 0.86 LPAR1 (0.38) GPR132CCR5
SCHEMBL1007288 0.85 LPAR1 (0.41) CCR5
SCHEMBL1008391 0.85 LPAR1 (0.37) GPR132
SCHEMBL1007597 0.84 LPAR1 (0.38) CCR5
SCHEMBL1008126 0.84 EGLN1 (0.42) PPARG
SCHEMBL1008902 0.83 GCK (0.38) P2RX3GPR132GCK
SCHEMBL1009307 0.83 NPY5R (0.43) GPR132
SCHEMBL1007742 0.82 GPR132 (0.42) FFAR4GPR132GCK
SCHEMBL1008789 0.82 KCNH2 (0.40) GPR132GCK

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 P2RX3 2029/4885BACE1 3264/4885BACE2 2642/4885

“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.