SCHEMBL6003292

SCHEMBL6003292

[CH](Oc1ccccc1)c1ccc2ncsc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1B Q9Y463 15/20 0.45
DYRK1A Q13627 14/20 0.45
DYRK2 Q92630 14/20 0.45
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CLK1 P49759 14/20 0.44
CLK4 Q9HAZ1 12/20 0.44
CSNK2A2 P19784 2/20 0.44
CSNK2B P67870 2/20 0.44
CSNK2A1 P68400 2/20 0.44
PIK3CD O00329 1/20 0.44
PRKCB P05771 1/20 0.44
PIK3CA P42336 1/20 0.44
PIK3CG P48736 1/20 0.44
HASPIN Q8TF76 1/20 0.44
DYRK3 O43781 11/20 0.44
CLK2 P49760 11/20 0.44
CLK3 P49761 11/20 0.44
DYRK4 Q9NR20 11/20 0.44
GSK3B P49841 10/20 0.44

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
SCHEMBL6002184 0.88 ALDH1A1 (0.44) DYRK1BDYRK1ADYRK2ALDH1A1HSD17B10
SCHEMBL23480179 0.75 DYRK1A (0.51) DYRK1BDYRK1ADYRK2ALDH1A1HSD17B10
SCHEMBL8517411 0.74 IKBKB (0.55) DYRK1AALDH1A1HSD17B10KDM4ENPC1
SCHEMBL6003293 0.72 SLC6A4 (0.47) ALDH1A1HSD17B10KDM4ENPC1RAB9A
SCHEMBL28015693 0.72 DYRK1A (0.49) DYRK1BDYRK1ADYRK2ALDH1A1HSD17B10
SCHEMBL7218352 0.72 DYRK1A (0.49) DYRK1BDYRK1ADYRK2ALDH1A1HSD17B10
SCHEMBL1418925 0.72 DYRK1A (0.52) DYRK1BDYRK1ADYRK2ALDH1A1HSD17B10
SCHEMBL19140129 0.72 DYRK1A (0.52) DYRK1BDYRK1ADYRK2ALDH1A1HSD17B10
SCHEMBL27980410 0.72 DYRK1A (0.49) DYRK1BDYRK1ADYRK2ALDH1A1HSD17B10
SCHEMBL12903100 0.69 DYRK1A (0.47) DYRK1BDYRK1ADYRK2ALDH1A1HSD17B10

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
CN-100497345-C 2, 3-dihydro-6-nitroimidazolo [2,1-b] oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2009-06-10 CN disclosed
CN-1878777-A 2,3-dihydro-6-nitroimidazo (2,1-b) oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2006-12-13 CN disclosed
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO disclosed