SCHEMBL5544293

SCHEMBL5544293

O=[C]OCC=Cc1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
AHR P35869 1/20 0.39
FBP1 P09467 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GRIK1 P39086 1/20 0.39
GRIK2 Q13002 1/20 0.39
GRIK3 Q13003 1/20 0.39
NFE2L2 Q16236 2/20 0.37
KCNH2 Q12809 2/20 0.37
PTGS2 P35354 1/20 0.37
DAO P14920 1/20 0.37
IDO1 P14902 2/20 0.36
PPARG P37231 1/20 0.36
CACNA1B Q00975 1/20 0.35
MAOB P27338 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
SCHEMBL5544290 1.00 CYP1A2 (0.41) CYP1A2AHRFBP1HSD17B10GRIK1
SCHEMBL5539802 0.82 CYP1A2 (0.39) CYP1A2AHRFBP1HSD17B10GRIK1
SCHEMBL5539796 0.82 CYP1A2 (0.39) CYP1A2AHRFBP1HSD17B10GRIK1
SCHEMBL5536696 0.81 RELA (0.41) FBP1GRIK1GRIK2NFE2L2PTGS2
SCHEMBL3793245 0.81 APP (0.42) IDO1MAOB
SCHEMBL5547901 0.81 GRIK1 (0.39) CYP1A2GRIK1GRIK2IDO1MAOB
SCHEMBL5541067 0.81 HSD11B1 (0.41) FBP1GRIK1GRIK2NFE2L2IDO1
SCHEMBL5541069 0.81 HSD11B1 (0.41) FBP1GRIK1GRIK2NFE2L2IDO1
SCHEMBL5547894 0.81 GRIK1 (0.39) CYP1A2GRIK1GRIK2IDO1MAOB
SCHEMBL3793250 0.81 APP (0.42) IDO1MAOB

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 7 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
US-5026838-A Starting materials for polynucleotides NIPPON ZEON CO., LTD. (JP) 1991-06-25 US disclosed
EP-0216357-A2 Phosphoramidite compounds and process for production thereof NIPPON ZEON CO., LTD. (JP) 1987-04-01 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 CYP1A2 659/4885AHR 1471/4885FBP1 1110/4885

“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.