SCHEMBL11228112

SCHEMBL11228112

CCCCCCNc1nc(-c2ccncc2)ccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47
LATS1 O95835 2/20 0.45
LATS2 Q9NRM7 2/20 0.45
HCAR3 P49019 1/20 0.40
LMNA P02545 1/20 0.39
RIPK1 Q13546 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
NAAA Q02083 1/20 0.39
NPC1 O15118 1/20 0.38
STAT1 P42224 1/20 0.38
RAB9A P51151 1/20 0.38
GAA P10253 1/20 0.38
TXNRD1 Q16881 5/20 0.38
PRKCA P17252 2/20 0.38
PRKCD Q05655 2/20 0.38
GSR P00390 2/20 0.38

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
SCHEMBL11233319 0.95 L3MBTL1 (0.52) L3MBTL1TP53POLBLATS1LATS2
SCHEMBL11238719 0.85 GAA (0.47) L3MBTL1TP53POLBLATS1LATS2
SCHEMBL11235434 0.83 PRKCD (0.51) POLBLATS1LATS2LMNAALDH1A1
SCHEMBL11231846 0.82 POLB (0.52) POLBHCAR3LMNAALDH1A1MAPT
SCHEMBL11237821 0.79 LATS1 (0.52) LATS1LATS2LMNAALDH1A1MAPT
SCHEMBL11653146 0.79 MAPT (0.58) L3MBTL1HCAR3LMNARIPK1ALDH1A1
SCHEMBL11650084 0.79 L3MBTL1 (0.59) L3MBTL1POLBHCAR3LMNARIPK1
SCHEMBL11235404 0.78 POLB (0.45) POLBLATS1LATS2LMNAALDH1A1
SCHEMBL9041749 0.77 MAPT (0.59) L3MBTL1POLBHCAR3LMNARIPK1
SCHEMBL11237124 0.76 POLB (0.49) L3MBTL1TP53POLBLATS1LATS2

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