SCHEMBL1794516

SCHEMBL1794516

COC(=O)c1cc(CO)cc(OC(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
SLC7A5 Q01650 2/20 0.43
PRKCA P17252 2/20 0.42
PRKCD Q05655 2/20 0.42
CYP4F2 P78329 2/20 0.42
CYP4A11 Q02928 2/20 0.42
ULK1 O75385 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
HSD17B10 Q99714 1/20 0.40
POLB P06746 2/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 2/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
GAA P10253 1/20 0.40
NFKB1 P19838 1/20 0.40

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
SCHEMBL15391096 0.89 ALDH1A1 (0.44) ALDH1A1SLC7A5CYP4F2CYP4A11ULK1
SCHEMBL2176465 0.85 GCK (0.44) SLC7A5PRKCAPRKCD
SCHEMBL1791405 0.85 CA1 (0.50) ALDH1A1ULK1CA12CA1CA2
SCHEMBL1107694 0.85 CA1 (0.50) ALDH1A1ULK1CA12CA1CA2
SCHEMBL1796030 0.84 KMT2A (0.51) ALDH1A1POLBGRIN2DGRIN3BGRIN1
SCHEMBL31371222 0.83 CA1 (0.48) ALDH1A1SLC7A5PRKCAPRKCDCYP4F2
SCHEMBL2255610 0.83 CA1 (0.48) ALDH1A1SLC7A5PRKCAPRKCDCYP4F2
SCHEMBL3599562 0.83 GCK (0.42) ALDH1A1CYP4A11POLBKMT2A
SCHEMBL14191840 0.83 PARP10 (0.53) ALDH1A1PRKCAPRKCDCYP4F2CYP4A11
SCHEMBL10068564 0.82 XDH (0.44) ALDH1A1SLC7A5PRKCAPRKCDCYP4F2

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 57 patents — showing the first 20. 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-7951830-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2011-05-31 US disclosed
CN-101704797-A compounds effecting glucokinase ASTRAZANECA AB 2010-05-12 CN 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-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
EP-1568367-B3 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-09-02 EP disclosed
EP-1568367-B3 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-09-02 EP disclosed
EP-1529530-B3 Compounds affecting glucokinase ASTRAZENECA AB (SE) 2009-09-02 EP disclosed
EP-1568367-A1 Compounds effecting glucokinase AstraZeneca AB (SE) 2005-08-31 EP disclosed
EP-1529530-A1 Compounds affecting glucokinase AstraZeneca AB (SE) 2005-05-11 EP disclosed
US-20050080106-A1 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2005-04-14 US disclosed
US-20040214868-A1 Amino nicotinate derivatives as glucokinase (GLK) modulators ASTRAZENECA AB (SE) 2004-10-28 US disclosed
EP-1420784-A1 COMPOUNDS EFFECTING GLUCOKINASE Astrazeneca AB (SE) 2004-05-26 EP disclosed
EP-1404335-A1 AMINO NICOTINATE DERIVATIVES AS GLUCOKINASE (GLK) MODULATORS Astrazeneca AB (SE) 2004-04-07 EP disclosed
WO-2003015774-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2003-02-27 WO disclosed
WO-2003015774-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2003-02-27 WO disclosed
WO-2003000267-A1 AMINO NICOTINATE DERIVATIVES AS GLUCOKINASE (GLK) MODULATORS ASTRAZENECA AB (SE) 2003-01-03 WO disclosed
WO-2003000267-A1 AMINO NICOTINATE DERIVATIVES AS GLUCOKINASE (GLK) MODULATORS ASTRAZENECA AB (SE) 2003-01-03 WO 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 (3 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-20050080106-A1 Compounds effecting glucokinase GCKR, GCK, SLC5A2 ALDH1A1 1137/4885SLC7A5 1746/4885PRKCA 591/4885
US-20040214868-A1 Amino nicotinate derivatives as glucokinase (GLK) modulators GCK, GCKR, NADK ALDH1A1 1486/4885SLC7A5 648/4885PRKCA 874/4885
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE GCKR, GCK, SLC5A2 ALDH1A1 1137/4885SLC7A5 1746/4885PRKCA 591/4885

“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.