SCHEMBL1860438

SCHEMBL1860438

COC(=O)[C@H](C[C@@H]1CCC(F)(F)C1)c1ccc(S(C)(=O)=O)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.47
GCK P35557 4/20 0.44
SLC6A3 Q01959 9/20 0.39
SCN9A Q15858 2/20 0.37
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36

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
SCHEMBL1860437 1.00 KCNH2 (0.47) KCNH2GCKSLC6A3SCN9ASLC6A2
SCHEMBL1860441 1.00 KCNH2 (0.47) KCNH2GCKSLC6A3SCN9ASLC6A2
SCHEMBL1860435 1.00 KCNH2 (0.47) KCNH2GCKSLC6A3SCN9ASLC6A2
SCHEMBL1867444 0.89 KCNH2 (0.47) KCNH2GCKSLC6A3SCN9ASLC6A2
SCHEMBL1863778 0.89 KCNH2 (0.47) KCNH2GCKSCN9A
SCHEMBL1859498 0.89 KCNH2 (0.47) KCNH2GCKSCN9A
SCHEMBL2642340 0.89 SLC6A3 (0.49) SLC6A3SLC6A2SLC6A4
SCHEMBL21882880 0.84 KCNH2 (0.62) KCNH2GCKSLC6A3SLC6A2SLC6A4
SCHEMBL2646278 0.84 KCNH2 (0.62) KCNH2GCKSLC6A3SLC6A2SLC6A4
SCHEMBL2641989 0.84 KCNH2 (0.46) KCNH2GCKSLC6A3SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7935699-B2 Pyrazole glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2011-05-03 US disclosed
EP-2261216-A2 Pyrazoles as glucokinase activators F. Hoffmann-La Roche AG (CH) 2010-12-15 EP disclosed
EP-2046755-A2 PYRAZOLES AS GLUCOKINASE ACTIVATORS F. Hoffmann-Roche AG (CH) 2009-04-15 EP disclosed
WO-2008012227-A2 PYRAZOLES AS GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2008-01-31 WO disclosed
US-20080021032-A1 Pyrazole glucokinase activators BERTHEL STEVEN JOSEPH 2008-01-24 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-20080021032-A1 Pyrazole glucokinase activators GCKR, GCK, GALK1 KCNH2 2241/4885GCK 2/4885SLC6A3 3386/4885

“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.