SCHEMBL1960337

SCHEMBL1960337

C[S+]([O-])c1ccc(C(O)(CC2CCCC2)c2cc3cc(F)cnc3n2S(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GCK P35557 2/20 0.33
CHRM3 P20309 1/20 0.32
RORC P51449 1/20 0.31
HTR6 P50406 1/20 0.31
CNR2 P34972 1/20 0.30

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
SCHEMBL1962132 0.98 GCK (0.32) GCKCHRM3RORCHTR6
SCHEMBL1960340 0.90 GCK (0.36) GCKCHRM3
SCHEMBL1959597 0.89 CCR2 (0.36) GCKCHRM3RORC
SCHEMBL1959161 0.87 GCK (0.33) GCKCHRM3HTR6
SCHEMBL2054075 0.87 NR3C2 (0.32) GCKCHRM3RORC
SCHEMBL1961245 0.86 CHRM3 (0.33) GCKCHRM3HTR6
SCHEMBL27873097 0.83 NR1H3 (0.30) CHRM3
SCHEMBL27889561 0.83 FKBP1A (0.32) CHRM3
SCHEMBL1961501 0.78 GCK (0.45) GCKCHRM3
SCHEMBL1962937 0.75 GCK (0.40) GCKCHRM3HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513103-A1 AZAINDOLE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2012-10-24 EP disclosed
US-8222416-B2 Azaindole glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-07-17 US disclosed
WO-2011073117-A1 AZAINDOLE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2011-06-23 WO disclosed
US-20110144105-A1 AZAINDOLE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2011-06-16 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-20110144105-A1 AZAINDOLE GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 GCK 1/4885CHRM3 3330/4885RORC 2220/4885

“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.