SCHEMBL5536439

SCHEMBL5536439

[CH2]CCCCc1cccc2ncoc12

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 13/20 0.57
MTNR1B P49286 13/20 0.57
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
CHRM1 P11229 1/20 0.36
ELANE P08246 1/20 0.32
ACLY P53396 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
SCHEMBL5541073 0.98 MTNR1A (0.56) MTNR1AMTNR1BHTR2AHTR2CCHRM1
SCHEMBL5537121 0.95 MTNR1A (0.58) MTNR1AMTNR1BHTR2AHTR2CCHRM1
SCHEMBL5541930 0.88 MTNR1A (0.54) MTNR1AMTNR1BHTR2AHTR2CCHRM1
SCHEMBL27610316 0.84 MTNR1A (0.62) MTNR1AMTNR1BHTR2AHTR2CCHRM1
SCHEMBL31561708 0.82 MTNR1A (0.62) MTNR1AMTNR1BHTR2AHTR2CCHRM1
SCHEMBL3819476 0.81 MTNR1A (0.49) MTNR1AMTNR1BHTR2AHTR2CCHRM1
SCHEMBL5541759 0.74 MTNR1A (0.33) MTNR1AMTNR1BHTR2AHTR2C
SCHEMBL17361326 0.74 MTNR1A (0.49) MTNR1AMTNR1BHTR2AHTR2CCHRM1
SCHEMBL21067244 0.74 MTNR1A (0.49) MTNR1AMTNR1BHTR2AHTR2CCHRM1
SCHEMBL5539234 0.73 MTNR1A (0.32) MTNR1AMTNR1B

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 MTNR1A 1560/4885MTNR1B 1562/4885HTR2A 4120/4885

“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.