SCHEMBL1008674

SCHEMBL1008674

O=C(O)C(CC1CCCC1)n1ncc(Oc2cccc3c2CCCC3)cc1=O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.36
ALOX5 P09917 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
RXRA P19793 8/20 0.36
RXRB P28702 8/20 0.36
RXRG P48443 5/20 0.36
S1PR5 Q9H228 1/20 0.35
KDM4C Q9H3R0 4/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
PTGIR P43119 3/20 0.34
PTGDR Q13258 2/20 0.34
BTK Q06187 1/20 0.33

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
SCHEMBL1009331 0.85 GCK (0.48) RXRARXRBRXRG
SCHEMBL1008567 0.85 GCK (0.48) RXRARXRBRXRG
SCHEMBL1009373 0.85 GCK (0.48) RXRARXRBRXRG
SCHEMBL2654813 0.85 RXRA (0.39) PTGESALOX5PPARGPPARARXRA
SCHEMBL2657261 0.85 RXRA (0.39) PTGESALOX5PPARGPPARARXRA
SCHEMBL2656662 0.85 RXRA (0.39) PTGESALOX5PPARGPPARARXRA
SCHEMBL1009403 0.85 LPAR1 (0.41) PPARGKDM4C
SCHEMBL1008589 0.84 FNTA (0.36) RXRARXRBRXRG
SCHEMBL1008584 0.84 HIF1A (0.36) KDM4C
SCHEMBL1008126 0.83 EGLN1 (0.42) PPARGPTGIRPTGDRBTK

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 PTGES 1645/4885ALOX5 2091/4885PPARG 88/4885

“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.