SCHEMBL5542879

SCHEMBL5542879

O=[C]OC1CCN(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.49
FFAR4 Q5NUL3 7/20 0.43
DPP4 P27487 3/20 0.40
NOTUM Q6P988 2/20 0.37
ACACB O00763 1/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HTR3E A5X5Y0 1/20 0.35
HTR3B O95264 1/20 0.35
HTR1D P28221 1/20 0.35
HTR2C P28335 1/20 0.35
HTR3A P46098 1/20 0.35
HTR3D Q70Z44 1/20 0.35
HTR3C Q8WXA8 1/20 0.35
SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL5539228 0.86 NOTUM (0.54) NOTUMACACBPOLBALDH1A1HTR3E
SCHEMBL5535612 0.85 NOTUM (0.50) NOTUM
SCHEMBL5542885 0.80 ADRB1 (0.50) ADRB1FFAR4DPP4NOTUMPOLB
SCHEMBL5541989 0.78 NOTUM (0.43) NOTUMACACBPOLBALDH1A1HTR3E
SCHEMBL5542372 0.77 NOTUM (0.39) NOTUMACACBPOLB
SCHEMBL5536217 0.72 MBTD1 (0.47) ADRB1FFAR4NOTUMACACBPOLB
SCHEMBL6498968 0.72 NOTUM (0.62) ADRB1FFAR4NOTUMPOLB
SCHEMBL29141963 0.71 ACACB (0.47) ADRB1FFAR4DPP4NOTUMACACB
SCHEMBL5543275 0.71 AKR1C3 (0.45) NOTUM
SCHEMBL19011735 0.70 ADRB1 (0.68) ADRB1FFAR4DPP4POLBALDH1A1

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 ADRB1 150/4885FFAR4 338/4885DPP4 3965/4885

“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.