SCHEMBL1960945

SCHEMBL1960945

COC(=O)c1ccc(C(=CC2CCCC2)c2cc3cccnc3n2S(=O)(=O)c2ccccc2)cc1F

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCK P35557 2/20 0.38
HSD17B10 Q99714 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 1/20 0.35
PDE4B Q07343 6/20 0.34
PTGDR2 Q9Y5Y4 2/20 0.34
MET P08581 3/20 0.34
KDM4E B2RXH2 2/20 0.34
PDE4D Q08499 1/20 0.34
CNR2 P34972 1/20 0.34
TSHR P16473 1/20 0.33
SLC40A1 Q9NP59 1/20 0.33

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
SCHEMBL1960944 1.00 GCK (0.38) GCKHSD17B10ALDH1A1LMNAMAPT
SCHEMBL1962294 0.94 GCK (0.37) GCKHSD17B10ALDH1A1LMNAMAPT
SCHEMBL1962291 0.94 GCK (0.37) GCKHSD17B10ALDH1A1LMNAMAPT
SCHEMBL1963061 0.90 ALDH1A1 (0.35) GCKHSD17B10ALDH1A1LMNAKDM4E
SCHEMBL1963059 0.90 ALDH1A1 (0.35) GCKHSD17B10ALDH1A1LMNAKDM4E
SCHEMBL1959819 0.90 GCK (0.40) GCKHSD17B10ALDH1A1LMNAMAPT
SCHEMBL1959817 0.90 GCK (0.40) GCKHSD17B10ALDH1A1LMNAMAPT
SCHEMBL1962397 0.89 ALDH1A1 (0.34) GCKHSD17B10ALDH1A1LMNAMAPT
SCHEMBL1962395 0.89 ALDH1A1 (0.34) GCKHSD17B10ALDH1A1LMNAMAPT
SCHEMBL1959233 0.84 ALDH1A1 (0.40) GCKHSD17B10ALDH1A1LMNAMAPT

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 1/4885HSD17B10 978/4885ALDH1A1 769/4885

“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.