SCHEMBL11235759

SCHEMBL11235759

OCCn1c(=S)[nH]c2ncc(-c3ccncc3)cc21

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 15/20 0.41
GRIN2B Q13224 15/20 0.41
CDC7 O00311 1/20 0.41
PKN1 Q16512 1/20 0.41
PKN2 Q16513 1/20 0.41
PDE3B Q13370 2/20 0.41
PDE3A Q14432 2/20 0.41
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
AAK1 Q2M2I8 1/20 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
SCHEMBL11237110 0.85 GRIN1 (0.57) GRIN1GRIN2B
SCHEMBL11237761 0.84 PDE3B (0.43) GRIN1GRIN2BPDE3BPDE3APIK3CD
SCHEMBL11244626 0.80 PDE3B (0.49) GRIN1GRIN2BPDE3BPDE3APIK3CD
SCHEMBL11227373 0.72 GRIN1 (0.57) GRIN1GRIN2B
SCHEMBL11236623 0.71 GRIN1 (0.55) GRIN1GRIN2B
SCHEMBL11244916 0.71 GRIN1 (0.61) GRIN1GRIN2B
SCHEMBL11363416 0.70 KMT2A (0.46) CDC7PKN1PKN2AAK1
SCHEMBL11230943 0.70 GRIN1 (0.55) GRIN1GRIN2B
SCHEMBL11166310 0.69 PDE3B (0.47) GRIN1GRIN2BCDC7PKN1PKN2
SCHEMBL11233554 0.69 GRIN1 (0.53) GRIN1GRIN2B

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-4309537-A Production of imidazo[4,5-b]pyridin-2-ones or thiones STERLING DRUG INC. (US) 1982-01-05 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