SCHEMBL1862332

SCHEMBL1862332

COCCn1ccc(NC(=O)C(C[C@H]2CCC(=O)C2)c2ccc(S(C)(=O)=O)c(Cl)c2)n1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCK P35557 14/20 0.65
KCNH2 Q12809 3/20 0.51
CACNA1G O43497 1/20 0.33
CACNA1H O95180 1/20 0.33
CACNA1I Q9P0X4 1/20 0.33
TYK2 P29597 2/20 0.32

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
SCHEMBL1862329 1.00 GCK (0.65) GCKKCNH2CACNA1GCACNA1HCACNA1I
SCHEMBL1862090 0.92 GCK (0.54) GCKKCNH2CACNA1GCACNA1HCACNA1I
SCHEMBL1862085 0.92 GCK (0.54) GCKKCNH2CACNA1GCACNA1HCACNA1I
SCHEMBL1863080 0.92 GCK (0.68) GCKKCNH2
SCHEMBL1863079 0.92 GCK (0.68) GCKKCNH2
SCHEMBL1858012 0.91 GCK (0.61) GCKKCNH2CACNA1GCACNA1HCACNA1I
SCHEMBL1858008 0.91 GCK (0.61) GCKKCNH2CACNA1GCACNA1HCACNA1I
SCHEMBL1859561 0.90 GCK (0.66) GCKKCNH2
SCHEMBL1859560 0.90 GCK (0.66) GCKKCNH2
SCHEMBL1862665 0.90 KCNH2 (0.62) GCKKCNH2

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 3 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
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 GCK 2/4885KCNH2 2241/4885CACNA1G 3569/4885

“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.