SCHEMBL5540165

SCHEMBL5540165

Oc1ccc(N2CCN(CCCc3ccc(OC(F)(F)F)cc3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
GAA P10253 1/20 0.54
MAPT P10636 1/20 0.54
SIGMAR1 Q99720 7/20 0.50
DRD2 P14416 3/20 0.48
HTR1A P08908 2/20 0.48
HTR2A P28223 2/20 0.48
DRD3 P35462 2/20 0.48
TMEM97 Q5BJF2 2/20 0.48
OPRM1 P35372 1/20 0.48
DRD1 P21728 1/20 0.48
DRD5 P21918 1/20 0.48
CHRM4 P08173 1/20 0.48
HTR7 P34969 1/20 0.47
SLC6A4 P31645 3/20 0.46
SLC6A3 Q01959 3/20 0.46
GRM2 Q14416 1/20 0.45
HTR2C P28335 1/20 0.45
HRH1 P35367 1/20 0.45

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
SCHEMBL5546747 0.96 SIGMAR1 (0.53) ALDH1A1GAAMAPTSIGMAR1DRD2
SCHEMBL5540600 0.95 SIGMAR1 (0.52) ALDH1A1GAAMAPTSIGMAR1DRD2
SCHEMBL5544228 0.95 SIGMAR1 (0.52) ALDH1A1GAAMAPTSIGMAR1DRD2
SCHEMBL5540053 0.93 ALDH1A1 (0.50) ALDH1A1GAAMAPTSIGMAR1DRD2
SCHEMBL5540158 0.88 SIGMAR1 (0.50) ALDH1A1SIGMAR1DRD2HTR1AHTR2A
SCHEMBL5534516 0.85 ALDH1A1 (0.62) ALDH1A1GAAMAPTDRD2DRD3
SCHEMBL5546743 0.84 SIGMAR1 (0.53) ALDH1A1SIGMAR1DRD2HTR1AHTR2A
SCHEMBL5536064 0.84 ME2 (0.58) ALDH1A1GAAMAPTSIGMAR1DRD2
SCHEMBL5544222 0.83 SIGMAR1 (0.52) ALDH1A1SIGMAR1DRD2HTR1AHTR2A
SCHEMBL5540593 0.83 SIGMAR1 (0.52) ALDH1A1SIGMAR1DRD2HTR1AHTR2A

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 355/4885GAA 4165/4885MAPT 4117/4885

“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.