SCHEMBL1962265

SCHEMBL1962265

COC(=O)c1cnc2[nH]c(/C(=C/C3CCCC3)c3ccc(S(C)(=O)=O)cc3)cc2c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCK P35557 6/20 0.58
ATR Q13535 1/20 0.38
ABL1 P00519 9/20 0.38
KMT2A Q03164 1/20 0.36
SRC P12931 7/20 0.36
PTGS2 P35354 1/20 0.36
KDM4E B2RXH2 2/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36
RAB9A P51151 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL1962269 1.00 GCK (0.58) GCKATRABL1KMT2ASRC
SCHEMBL1960981 0.91 GCK (0.55) GCKATRKMT2A
SCHEMBL1960983 0.91 GCK (0.55) GCKATRKMT2A
SCHEMBL1963666 0.90 GCK (0.57) GCKABL1SRC
SCHEMBL1963665 0.90 GCK (0.57) GCKABL1SRC
SCHEMBL1961701 0.88 GCK (0.59) GCKABL1KMT2ASRCPTGS2
SCHEMBL1961702 0.88 GCK (0.59) GCKABL1KMT2ASRCPTGS2
SCHEMBL1962903 0.87 GCK (0.58) GCKATRKMT2APTGS2
SCHEMBL1962902 0.87 GCK (0.58) GCKATRKMT2APTGS2
SCHEMBL1962674 0.87 GCK (0.55) GCKKMT2APTGS2

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 1/4885ATR 4471/4885ABL1 2649/4885

“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.