SCHEMBL11225213

SCHEMBL11225213

O=c1[nH]c2ccc(-c3ccncc3)nc2n1CC(O)CO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 1/20 0.38
MMP9 P14780 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
GSK3B P49841 6/20 0.34
CDC7 O00311 2/20 0.34
PIM1 P11309 2/20 0.34
HIPK2 Q9H2X6 2/20 0.34
CLK4 Q9HAZ1 2/20 0.34
ROCK2 O75116 1/20 0.34
MAP4K4 O95819 1/20 0.34
PRKACA P17612 1/20 0.34
CDK2 P24941 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
MAP3K11 Q16584 1/20 0.33
BIRC2 Q13490 1/20 0.33
MAPK14 Q16539 1/20 0.33
DAO P14920 2/20 0.33

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
SCHEMBL11246747 0.86 TDP1 (0.34) KDM4EMAPK14MAPTPRMT5DYRK1A
SCHEMBL11234950 0.83 CDC7 (0.42) MTORGSK3BCDC7PIM1HIPK2
SCHEMBL11238965 0.80 CYP1A2 (0.42) GSK3BCDC7PIM1HIPK2CLK4
SCHEMBL11243737 0.78 PDE3B (0.43) DAO
SCHEMBL11234998 0.76 ALDH1A1 (0.52) GSK3BKDM4EMAPK1
SCHEMBL11243932 0.75 MPO (0.40) MTORGSK3BROCK2KDM4EMAPT
SCHEMBL11230498 0.75 ALDH1A1 (0.53) MTORGSK3BKDM4EMAPK1DYRK1A
SCHEMBL11238130 0.74 ALDH1A1 (0.47) GSK3BKDM4EMAPK1
SCHEMBL11230940 0.73 CTDSP1 (0.46) GSK3BKDM4EMAPK1MAPK14DYRK1A
SCHEMBL11223721 0.72 KDM4E (0.51) GSK3BCDC7PIM1HIPK2CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4317909-A Preparation of 1,3-dihydro-5-(pyridinyl)-2H-imidazo[4,5-b]pyridin-2-ones STERLING DRUG INC. (US) 1982-03-02 US disclosed
US-4294836-A 1,3-Dihydro-6-(pyridinyl)-2H-imidazo[4,5-b]pyridin-2-ones and -imidazo[4,5-b]-pyridine-2-thiones and their cardiotonic use STERLING DRUG INC. (US) 1981-10-13 US disclosed