SCHEMBL5534879

SCHEMBL5534879

O=C(c1ccc(OC(F)(F)F)cc1)N1CCC(O)CC1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.68
MGLL Q99685 1/20 0.67
HRH3 Q9Y5N1 2/20 0.59
GRM3 Q14832 1/20 0.58
EPHX2 P34913 4/20 0.56
LSS P48449 1/20 0.55
CACNA1B Q00975 1/20 0.54
HTR2B P41595 1/20 0.54
MAPK7 Q13164 7/20 0.53

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
SCHEMBL27629727 0.83 HPGD (0.65) HSD11B1MGLLHRH3EPHX2LSS
SCHEMBL25988870 0.81 HSD11B1 (0.57) HSD11B1MGLLHRH3EPHX2LSS
SCHEMBL5546406 0.81 HSD11B1 (0.60) HSD11B1MGLLHRH3EPHX2HTR2B
SCHEMBL12576441 0.81 HSD11B1 (1.00) HSD11B1MGLL
SCHEMBL13841325 0.81 EPHX2 (0.81) HSD11B1MGLLHRH3EPHX2LSS
SCHEMBL27492566 0.81 HRH3 (0.60) HSD11B1MGLLHRH3EPHX2LSS
SCHEMBL5450590 0.81 HRH3 (0.60) HSD11B1MGLLHRH3EPHX2LSS
SCHEMBL1812101 0.80 MGLL (0.74) HSD11B1MGLLHRH3EPHX2LSS
SCHEMBL17014217 0.80 HSD11B1 (0.59) HSD11B1MGLLHRH3EPHX2LSS
SCHEMBL5536446 0.80 GAA (0.71) HSD11B1MGLLGRM3EPHX2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
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
CN-101255170-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-09-03 CN disclosed
CN-101172981-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-05-07 CN disclosed
CN-100366624-C 2, 3-dihydro-6-nitroimidazo [2,1-b ] * azole compounds OTSUKA PHARMA CO LTD (JP) 2008-02-06 CN 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
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN 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 HSD11B1 256/4885MGLL 4717/4885HRH3 420/4885

“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.