SCHEMBL5546411

SCHEMBL5546411

[CH2]n1c(=O)oc2c(Cl)cccc21

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PSMB8 P28062 2/20 0.33
TTR P02766 3/20 0.33
AHR P35869 3/20 0.33
IDO1 P14902 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
POLB P06746 1/20 0.32
MAPK14 Q16539 1/20 0.31
NOTUM Q6P988 1/20 0.31
PSMB5 P28074 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
SCHEMBL5546415 0.78 JAK2 (0.42) ALDH1A1L3MBTL1TP53SMN1; SMN2PSMB8
SCHEMBL5543868 0.78 ASAH1 (0.41) ALDH1A1NPSR1
SCHEMBL5541186 0.70 ALDH1A1 (0.41) ALDH1A1L3MBTL1TP53SMN1; SMN2PSMB8
SCHEMBL4414547 0.69 HPGD (0.60) SMN1; SMN2IDO1POLB
SCHEMBL9715933 0.68 ALDH1A1 (0.40) ALDH1A1L3MBTL1TP53SMN1; SMN2IDO1
SCHEMBL3543457 0.68 TSHR (0.57) ALDH1A1SMN1; SMN2IDO1NPSR1
SCHEMBL4997130 0.63 IDO1 (0.45) ALDH1A1TP53IDO1
SCHEMBL8815383 0.61 TTR (0.65) ALDH1A1SMN1; SMN2PSMB8TTRAHR
SCHEMBL28617099 0.59 AHR (0.69) ALDH1A1PSMB8TTRAHRPSMB5
SCHEMBL8684869 0.59 CYP2A6 (0.55) ALDH1A1SMN1; SMN2NPSR1POLB

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 ALDH1A1 355/4885L3MBTL1 1931/4885TP53 4494/4885

“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.