SCHEMBL12670972

SCHEMBL12670972

COC(C)(C)Cn1ccc(NC(=O)[C@H](CC2CCOC2)c2ccc(S(C)(=O)=O)c(Cl)c2)n1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.50
GCK P35557 17/20 0.47

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
SCHEMBL1857184 0.90 KCNH2 (0.62) KCNH2GCK
SCHEMBL1857187 0.90 KCNH2 (0.62) KCNH2GCK
SCHEMBL1857543 0.89 GCK (0.56) KCNH2GCK
SCHEMBL1857545 0.89 GCK (0.56) KCNH2GCK
SCHEMBL1857668 0.88 KCNH2 (0.53) KCNH2GCK
SCHEMBL1863545 0.87 KCNH2 (0.55) KCNH2GCK
SCHEMBL1864748 0.87 KCNH2 (0.55) KCNH2GCK
SCHEMBL1855856 0.86 KCNH2 (0.48) KCNH2GCK
SCHEMBL1856508 0.85 KCNH2 (0.49) KCNH2GCK
SCHEMBL1856507 0.85 KCNH2 (0.49) KCNH2GCK

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 2 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
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 2/4885

“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.