SCHEMBL11223316

SCHEMBL11223316

O=[N+]([O-])c1ccc(-c2ccncc2)nc1NCC(O)CO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.41
MAPT P10636 2/20 0.38
GSTP1 P09211 1/20 0.37
GSTM2 P28161 1/20 0.37
PDE7A Q13946 2/20 0.36
PRKCD Q05655 3/20 0.35
PRKCA P17252 3/20 0.35
PRKCH P24723 2/20 0.35
PRKCE Q02156 2/20 0.35
PRKCQ Q04759 2/20 0.35
CYP1A2 P05177 1/20 0.35
PRKCB P05771 1/20 0.35
ALDH1A1 P00352 1/20 0.34
SYK P43405 3/20 0.34
GAA P10253 2/20 0.34
PDE4B Q07343 1/20 0.34
PDE4D Q08499 1/20 0.34
PDE7B Q9NP56 1/20 0.34
HTT P42858 1/20 0.34
NCOA1 Q15788 1/20 0.34

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
SCHEMBL11235434 0.83 PRKCD (0.51) MAPTPDE7APRKCDPRKCAPRKCH
SCHEMBL11238719 0.80 GAA (0.47) MAPTPDE7APRKCACYP1A2ALDH1A1
SCHEMBL11231870 0.79 HDAC2 (0.46) PRKCDPRKCAPRKCHPRKCEPRKCQ
SCHEMBL11233747 0.78 GLA (0.50) GLAMAPTCYP1A2ALDH1A1SYK
SCHEMBL11233319 0.76 L3MBTL1 (0.52) MAPTPDE7APRKCDPRKCAPRKCH
SCHEMBL5832744 0.76 TXNRD1 (0.46) GLAMAPTHTT
SCHEMBL11235404 0.75 POLB (0.45) MAPTPDE7APRKCAALDH1A1GAA
SCHEMBL11231846 0.75 POLB (0.52) MAPTPDE7APRKCDPRKCHPRKCE
SCHEMBL10352588 0.75 MAPT (0.54) GLAMAPTCYP1A2ALDH1A1HTT
SCHEMBL11241875 0.75 POLB (0.47) MAPTPDE7APRKCACYP1A2ALDH1A1

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