SCHEMBL5543328

SCHEMBL5543328

CCCCc1csc(CO[C]=O)n1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 3/20 0.40
BCHE P06276 3/20 0.34
HDAC1 Q13547 6/20 0.33
HDAC6 Q9UBN7 6/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
ADRB3 P13945 3/20 0.32
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
NOS2 P35228 1/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL5535826 0.95 SLC6A3 (0.37) SLC6A3BCHEHDAC1HDAC6TLR8
SCHEMBL5547243 0.94 KCNH2 (0.39) SLC6A3BCHEHDAC1HDAC6ADRB3
SCHEMBL5546523 0.82 SLC6A3 (0.41) SLC6A3BCHEHDAC1HDAC6ADRB3
SCHEMBL21699960 0.78 SLC6A3 (0.52) SLC6A3HDAC1HDAC6TLR8TLR7
SCHEMBL5539297 0.78 SLC6A3 (0.41) SLC6A3BCHE
SCHEMBL7488547 0.77 SLC6A3 (0.39) SLC6A3BCHEHDAC1HDAC6TLR8
SCHEMBL12674305 0.77 SLC6A3 (0.44) SLC6A3HDAC1HDAC6TLR8TLR7
SCHEMBL25653945 0.75 SLC6A3 (0.50) SLC6A3HDAC1HDAC6TLR8TLR7
SCHEMBL5536462 0.74 NOS1 (0.36)
SCHEMBL27426865 0.74 SLC6A3 (0.43) SLC6A3HDAC1HDAC6TLR8TLR7

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 SLC6A3 1944/4885BCHE 4833/4885HDAC1 322/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.