SCHEMBL2664231

SCHEMBL2664231

Cc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc(O[C@@H](C)CO)c1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.58
KCNH2 Q12809 2/20 0.48

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
SCHEMBL12678178 0.88 GCK (0.57) GCKKCNH2
SCHEMBL9892945 0.86 GCK (0.63) GCKKCNH2
SCHEMBL1107539 0.86 GCK (0.63) GCKKCNH2
SCHEMBL2664173 0.86 GCK (0.59) GCKKCNH2
SCHEMBL1107296 0.85 GCK (0.62) GCKKCNH2
SCHEMBL2664261 0.83 SMN1; SMN2 (0.52) GCK
SCHEMBL13127407 0.81 GCK (0.57) GCKKCNH2
SCHEMBL9986967 0.78 GCK (0.82) GCK
SCHEMBL9986970 0.78 GCK (0.82) GCK
SCHEMBL2660511 0.77 GCK (0.65) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7812048-B2 Glucokinase activators and methods of using same BRISTOL-MYERS SQUIBB COMPANY (US) 2010-10-12 US disclosed
US-20090030046-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2009-01-29 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-20090030046-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, GCK, HK1 GCK 2/4885KCNH2 413/4885

“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.