SCHEMBL5547243

SCHEMBL5547243

CCCCCCc1csc(CO[C]=O)n1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.39
ADRB3 P13945 7/20 0.37
ADRB2 P07550 5/20 0.37
ADRB1 P08588 5/20 0.37
SLC6A3 Q01959 2/20 0.36
BCHE P06276 1/20 0.35
ECE1 P42892 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HDAC1 Q13547 2/20 0.32
HDAC6 Q9UBN7 2/20 0.32
PDE5A O76074 1/20 0.32
GPR84 Q9NQS5 4/20 0.32

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 0.99 SLC6A3 (0.37) KCNH2ADRB3ADRB2ADRB1SLC6A3
SCHEMBL5543328 0.94 SLC6A3 (0.40) KCNH2ADRB3ADRB2ADRB1SLC6A3
SCHEMBL5546523 0.89 SLC6A3 (0.41) KCNH2ADRB3ADRB2ADRB1SLC6A3
SCHEMBL6235049 0.80 KCNH2 (0.50) KCNH2ADRB3ADRB2ADRB1SLC6A3
SCHEMBL14226438 0.78 KCNH2 (0.48) KCNH2ADRB3ADRB2ADRB1SLC6A3
SCHEMBL3849941 0.78 SLC6A3 (0.48) KCNH2ADRB3ADRB2ADRB1SLC6A3
SCHEMBL25653945 0.76 SLC6A3 (0.50) KCNH2ADRB3ADRB2ADRB1SLC6A3
SCHEMBL19197711 0.76 KCNH2 (0.46) KCNH2ADRB3ADRB2ADRB1SLC6A3
SCHEMBL5539297 0.75 SLC6A3 (0.41) SLC6A3BCHE
SCHEMBL5251412 0.73 KCNH2 (0.43) KCNH2ADRB3ADRB2ADRB1SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
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 KCNH2 3503/4885ADRB3 54/4885ADRB2 149/4885

“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.