SCHEMBL2669710

SCHEMBL2669710

Cc1cnc2c(c1)OCCN(C)C2=O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.40
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
CYP11B2 P19099 2/20 0.35
NOTUM Q6P988 1/20 0.35
LRRK2 Q5S007 1/20 0.35
CYP11B1 P15538 1/20 0.35
KMT2A Q03164 1/20 0.33
KDM5B Q9UGL1 1/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
AR P10275 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
PIK3CD O00329 2/20 0.32
METAP2 P50579 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
SCHEMBL2071260 0.84 CYP11B2 (0.41) GRM5KDM4EATMCYP11B2NOTUM
SCHEMBL46326 0.81 GRM5 (0.57) GRM5KDM4EATMCYP11B2CYP11B1
SCHEMBL15469462 0.74 MAOB (0.39) GRM5KMT2A
SCHEMBL12773758 0.74 KDM4E (0.39) GRM5KDM4EATMLRRK2KDM5B
SCHEMBL2669108 0.73 HTR1A (0.44) GRM5NOTUMKMT2A
SCHEMBL2669102 0.73 KDM4E (0.43) GRM5KDM4EATMCYP11B2NOTUM
SCHEMBL20786546 0.72 NPC1 (0.43) GRM5KMT2AARPIK3CAPIK3CB
SCHEMBL2669099 0.71 ALDH1A1 (0.41) GRM5KDM4EATMKMT2A
SCHEMBL25463276 0.69 KMT2A (0.38) LRRK2KMT2A
SCHEMBL10274465 0.69 PIK3CA (0.52) KDM4EKMT2APIK3CAPIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902200-B2 3-[6-(Azetidine-1-carbonyl)pyridin-3-yl]oxy-5-[(3S)-1-methyl-2-oxo-pyrrolidin-3-yl]oxy-N-(5-methylpyrazin-2-yl)benzamide; activates glucokinase leading to decreased glucose threshold for insulin secretion and lowering of blood glucose by increasing hepatic glucose uptake; antidiabetic agents; obesity ASTRAZENECA AB (SE) 2011-03-08 US disclosed
US-7902200-B2 3-[6-(Azetidine-1-carbonyl)pyridin-3-yl]oxy-5-[(3S)-1-methyl-2-oxo-pyrrolidin-3-yl]oxy-N-(5-methylpyrazin-2-yl)benzamide; activates glucokinase leading to decreased glucose threshold for insulin secretion and lowering of blood glucose by increasing hepatic glucose uptake; antidiabetic agents; obesity ASTRAZENECA AB (SE) 2011-03-08 US disclosed
US-20110053910-A1 2 -HETEROCYCLYLOXYBENZOYL AMINO HETEROCYCLYL COMPOUNDS AS MODULATORS OF GLUCOKINASE FOR THE TREATMENT OF TYPE 2 DIABETES ASTRAZENECA AB (SE) 2011-03-03 US disclosed
US-20110053910-A1 2 -HETEROCYCLYLOXYBENZOYL AMINO HETEROCYCLYL COMPOUNDS AS MODULATORS OF GLUCOKINASE FOR THE TREATMENT OF TYPE 2 DIABETES ASTRAZENECA AB (SE) 2011-03-03 US disclosed
US-20080171734-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2008-07-17 US disclosed
US-20080171734-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2008-07-17 US disclosed
WO-2008050101-A2 BENZOYL AMINO HETEROCYCLYL COMPOUNDS USEFUL IN THE TREATMENT OF A DISEASE MEDIATED THROUGH GLK ASTRAZENECA AB (SE) 2008-05-02 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 (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-20080171734-A1 CHEMICAL COMPOUNDS HK1, GCKR, GCK GRM5 1036/4885KDM4E 2693/4885ATM 4737/4885
US-20110053910-A1 2 -HETEROCYCLYLOXYBENZOYL AMINO HETEROCYCLYL COMPOUNDS AS MODULATORS OF GLUCOKINASE FOR THE TREATMENT OF TYPE 2 DIABETES GCK, GCKR, HK1 GRM5 1683/4885KDM4E 1580/4885ATM 3581/4885

“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.