SCHEMBL11238722

SCHEMBL11238722

CCCCNc1cc(-c2ccncc2)cnc1N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.60
CDC7 O00311 2/20 0.60
ROCK2 O75116 2/20 0.60
MAP4K4 O95819 2/20 0.60
PIM1 P11309 2/20 0.60
PRKACA P17612 2/20 0.60
CDK2 P24941 2/20 0.60
HIPK2 Q9H2X6 2/20 0.60
CLK4 Q9HAZ1 2/20 0.60
IRAK4 Q9NWZ3 2/20 0.60
TLR8 Q9NR97 2/20 0.48
KDM6B O15054 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
PIK3CD O00329 1/20 0.43
PIK3CA P42336 1/20 0.43
PIK3CB P42338 1/20 0.43
PIK3CG P48736 1/20 0.43
LATS1 O95835 3/20 0.42
LATS2 Q9NRM7 2/20 0.42
PRKCH P24723 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
SCHEMBL11237661 0.92 GSK3B (0.50) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL11241142 0.86 PIM1 (0.46) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL11235379 0.85 PIK3C3 (0.46) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL11241274 0.85 GSK3B (0.46) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL11230110 0.83 GSK3B (0.49) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL11249288 0.83 GSK3B (0.43) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL11237193 0.82 KDM4E (0.47) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL11230514 0.77 AURKA (0.49) GSK3BPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL11231162 0.77 LATS1 (0.49) GSK3BCDC7ROCK2MAP4K4PIM1
SCHEMBL20703614 0.76 TLR8 (0.51) GSK3BCDC7ROCK2MAP4K4PIM1

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
US-4309537-A Production of imidazo[4,5-b]pyridin-2-ones or thiones STERLING DRUG INC. (US) 1982-01-05 US disclosed
US-4297360-A 5-(Pyridinyl)pyridine-2,3-diamines, preparation thereof and their cardiotonic use STERLING DRUG INC. (US) 1981-10-27 US disclosed
US-4294837-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
US-4276293-A Compositions and their preparation STERLING DRUG INC. (US) 1981-06-30 US disclosed