SCHEMBL5540765

SCHEMBL5540765

CN(C[C@](C)(O)Cn1cc([N+](=O)[O-])nc1Cl)C1CCN(c2ccc(C#N)cc2)CC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.34
AR P10275 5/20 0.33
LMNA P02545 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
JAK2 O60674 2/20 0.33
JAK3 P52333 2/20 0.33
PTGS1 P23219 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
FFAR2 O15552 1/20 0.32
TACR3 P29371 1/20 0.32
CHRM4 P08173 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL5540771 1.00 CYP3A4 (0.34) CYP3A4ARLMNAGPR119JAK2
SCHEMBL5539485 0.91 KMT2A (0.38) CYP3A4LMNAPTGS1SLC6A2SLC6A4
SCHEMBL5539491 0.91 KMT2A (0.38) CYP3A4LMNAPTGS1SLC6A2SLC6A4
SCHEMBL5535342 0.88 SERPINE1 (0.38) CYP3A4LMNAGPR119PTGS1SLC6A2
SCHEMBL5535348 0.88 SERPINE1 (0.38) CYP3A4LMNAGPR119PTGS1SLC6A2
SCHEMBL5536822 0.85 PTGS1 (0.46) CYP3A4PTGS1SLC6A2SLC6A4CHRM4
SCHEMBL5536827 0.85 PTGS1 (0.46) CYP3A4PTGS1SLC6A2SLC6A4CHRM4
SCHEMBL5540109 0.78 NR1D1 (0.40) LMNAGPR119MEN1KMT2A
SCHEMBL5540112 0.78 NR1D1 (0.40) LMNAGPR119MEN1KMT2A
SCHEMBL5535657 0.73 KMT2A (0.42) LMNAKMT2ASMN1; SMN2

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 CYP3A4 1683/4885AR 254/4885LMNA 4152/4885

“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.