SCHEMBL1960157

SCHEMBL1960157

CCOC(=O)C(C)(C)Oc1cnc2[nH]c(/C(=C/C3CCCC3)c3ccc(S(C)(=O)=O)cc3)cc2c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GCK P35557 7/20 0.53
FBP1 P09467 6/20 0.34
PPARA Q07869 3/20 0.32
ABCB11 O95342 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
HTR2A P28223 1/20 0.32
PMP22 Q01453 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
PPARG P37231 3/20 0.32
KMT2A Q03164 1/20 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
SCHEMBL1960158 1.00 GCK (0.53) GCKFBP1PPARAABCB11CYP1A2
SCHEMBL1962038 0.90 GCK (0.56) GCKPPARACCNE1CDK2GPR119
SCHEMBL1962039 0.90 GCK (0.56) GCKPPARACCNE1CDK2GPR119
SCHEMBL1961702 0.84 GCK (0.59) GCKGPR119KMT2A
SCHEMBL1961701 0.84 GCK (0.59) GCKGPR119KMT2A
SCHEMBL1962903 0.83 GCK (0.58) GCKKMT2A
SCHEMBL1962902 0.83 GCK (0.58) GCKKMT2A
SCHEMBL1962504 0.82 GCK (0.54) GCKKMT2A
SCHEMBL1962502 0.82 GCK (0.54) GCKKMT2A
SCHEMBL1960935 0.82 GCK (0.55) GCKKMT2A

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 1/4885FBP1 52/4885PPARA 1077/4885

“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.