SCHEMBL5540668

SCHEMBL5540668

O=[C]OCCCOCCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HRH3 Q9Y5N1 2/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
IDO1 P14902 1/20 0.40
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
HCAR2 Q8TDS4 1/20 0.37
KCNH2 Q12809 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL5541072 0.96 MEN1 (0.41) MEN1KMT2AHRH3CA1CA2
SCHEMBL5540698 0.95 TDP1 (0.42) MEN1KMT2AHRH3CA1CA2
SCHEMBL5536033 0.95 TDP1 (0.42) MEN1KMT2AHRH3CA1CA2
SCHEMBL99521 0.93 MEN1 (0.49) MEN1KMT2AHRH3IDO1LMNA
SCHEMBL5536649 0.91 TDP1 (0.45) MEN1KMT2AHRH3IDO1LMNA
SCHEMBL5541578 0.90 TDP1 (0.48) MEN1KMT2AHRH3IDO1TDP1
SCHEMBL5546438 0.90 TDP1 (0.48) MEN1KMT2AHRH3IDO1TDP1
SCHEMBL97489 0.89 TDP1 (0.46) MEN1KMT2AHRH3IDO1LMNA
SCHEMBL5544955 0.89 MEN1 (0.49) MEN1KMT2AHRH3IDO1LMNA
SCHEMBL96790 0.88 TDP1 (0.49) MEN1KMT2AHRH3IDO1TDP1

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 MEN1 3295/4885KMT2A 4267/4885HRH3 420/4885

“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.