SCHEMBL2664708

SCHEMBL2664708

COc1ccccc1CNc1cc(OC(C)C)cc(C(=O)Nc2ncc(C(=O)O)s2)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 9/20 0.51
CSNK2A1 P68400 9/20 0.51
GCK P35557 3/20 0.46
MAPT P10636 1/20 0.45
HIF1A Q16665 1/20 0.45
SCD O00767 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
ABL1 P00519 1/20 0.42
SRC P12931 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ASPH Q12797 1/20 0.42
KDM8 Q8N371 1/20 0.42

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
SCHEMBL1798143 0.90 CSNK2A2 (0.47) CSNK2A2CSNK2A1GCKMAPTSCD
SCHEMBL2664704 0.89 SCD (0.52) CSNK2A2CSNK2A1GCKSCD
SCHEMBL2664705 0.85 CSNK2A2 (0.47) CSNK2A2CSNK2A1GCKSCD
SCHEMBL2664709 0.81 GCK (0.49) CSNK2A2CSNK2A1GCKSCD
SCHEMBL2664723 0.80 GCK (0.51) CSNK2A2CSNK2A1GCK
SCHEMBL2664707 0.80 GCK (0.45) CSNK2A2CSNK2A1GCK
SCHEMBL2664755 0.79 GCK (0.49) CSNK2A2CSNK2A1GCKSCD
SCHEMBL2664745 0.78 GCK (0.67) CSNK2A2CSNK2A1GCK
SCHEMBL2664751 0.78 GCK (0.69) CSNK2A2CSNK2A1GCKSCD
SCHEMBL6040690 0.77 MAPK14 (0.44) CSNK2A2CSNK2A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951830-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2011-05-31 US disclosed
US-7951830-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2011-05-31 US disclosed
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-7524957-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-04-28 US disclosed
US-20080207636-A1 Compounds Effecting Glucokinase ASTRAZENECA AB (SE) 2008-08-28 US disclosed
US-7390908-B2 Such as 2-[3,5-Di(2-chlorobenzyloxy)benzoyl)amino]-thiazole; for treatment of diabetes ASTRAZENECA AB (SE) 2008-06-24 US disclosed
US-7390908-B2 Such as 2-[3,5-Di(2-chlorobenzyloxy)benzoyl)amino]-thiazole; for treatment of diabetes ASTRAZENECA AB (SE) 2008-06-24 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 (2 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-20080207636-A1 Compounds Effecting Glucokinase GCKR, GCK, SLC5A2 CSNK2A2 444/4885CSNK2A1 432/4885GCK 2/4885
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE GCKR, GCK, SLC5A2 CSNK2A2 444/4885CSNK2A1 432/4885GCK 2/4885

“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.