SCHEMBL5545361

SCHEMBL5545361

O=COCCCC1CCC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.37
EPHX1 P07099 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SIGMAR1 Q99720 3/20 0.34
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
ADH7 P40394 1/20 0.34
HPGD P15428 1/20 0.33
NAAA Q02083 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
FKBP1A P62942 4/20 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
SCHEMBL3025958 0.96 CYP1A2 (0.41) CYP1A2EPHX1SMN1; SMN2SIGMAR1ADH1B
SCHEMBL5541873 0.94 CYP1A2 (0.45) CYP1A2EPHX1SMN1; SMN2SIGMAR1ADH1B
SCHEMBL5543638 0.94 CYP1A2 (0.45) CYP1A2EPHX1SMN1; SMN2SIGMAR1ADH1B
SCHEMBL3258085 0.94 CYP1A2 (0.45) CYP1A2EPHX1SMN1; SMN2SIGMAR1ADH1B
SCHEMBL5535372 0.94 EPHX1 (0.41) CYP1A2EPHX1SIGMAR1ADH1BADH1C
SCHEMBL5546608 0.91
SCHEMBL2191205 0.89 EPHX1 (0.45) CYP1A2EPHX1SIGMAR1HPGDNAAA
SCHEMBL3031792 0.88 EPHX1 (0.47) CYP1A2EPHX1SIGMAR1HPGDNAAA
SCHEMBL1451000 0.86
SCHEMBL5535569 0.86 SIGMAR1 (0.48) CYP1A2EPHX1SIGMAR1HPGDNAAA

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 CYP1A2 659/4885EPHX1 4071/4885SMN1; SMN2 3985/4885

“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.