SCHEMBL1008176

SCHEMBL1008176

COc1ccc(Oc2cnn(C(CC3CCCCC3)C(=O)O)c(=O)c2)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 1/20 0.41
ACACB O00763 2/20 0.39
NPC1 O15118 11/20 0.39
RAB9A P51151 10/20 0.39
POLB P06746 1/20 0.38
GCK P35557 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
ELANE P08246 1/20 0.35

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
SCHEMBL1008946 0.89 PTGDR2 (0.37) NPBWR1NPC1RAB9AGCKPTGDR2
SCHEMBL1009452 0.89 FFAR4 (0.38) ACACBPOLB
SCHEMBL1007921 0.86 NPBWR1 (0.44) NPBWR1NPC1RAB9AGCK
SCHEMBL1009446 0.84 NPBWR1 (0.37) NPBWR1NPC1RAB9AGCK
SCHEMBL1008255 0.84 CTSS (0.39) NPBWR1RAB9AGCK
SCHEMBL1008741 0.84 LPAR1 (0.39)
SCHEMBL1008584 0.83 HIF1A (0.36) NPBWR1GCK
SCHEMBL1008683 0.83 EGLN1 (0.41) GCKPTGDR2
SCHEMBL4294310 0.81 GCK (0.38) ACACBNPC1RAB9AGCK
SCHEMBL1008556 0.81 HIF1A (0.37) 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 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 NPBWR1 4667/4885ACACB 506/4885NPC1 3631/4885

“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.