SCHEMBL5538360

SCHEMBL5538360

O=[C]OCCCC/C=C/c1ccc(Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.36
CYP1A2 P05177 2/20 0.36
PPARA Q07869 1/20 0.35
CYSLTR1 Q9Y271 2/20 0.35
GRIK1 P39086 1/20 0.35
GRIK2 Q13002 1/20 0.35
GRIK3 Q13003 1/20 0.35
AHR P35869 1/20 0.34
FBP1 P09467 1/20 0.34
LTB4R Q15722 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
CYSLTR2 Q9NS75 1/20 0.33
PTGS2 P35354 1/20 0.33
NFE2L2 Q16236 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL5538363 1.00 KCNH2 (0.36) KCNH2CYP1A2PPARACYSLTR1GRIK1
SCHEMBL5540029 0.95 KCNH2 (0.37) KCNH2CYP1A2PPARACYSLTR1GRIK1
SCHEMBL5540023 0.95 KCNH2 (0.37) KCNH2CYP1A2PPARACYSLTR1GRIK1
SCHEMBL5539802 0.89 CYP1A2 (0.39) KCNH2CYP1A2PPARAGRIK1GRIK2
SCHEMBL5539796 0.89 CYP1A2 (0.39) KCNH2CYP1A2PPARAGRIK1GRIK2
SCHEMBL5535943 0.84 IDO1 (0.41) PPARALTB4RLTB4R2
SCHEMBL5535947 0.84 IDO1 (0.41) PPARALTB4RLTB4R2
SCHEMBL5538103 0.79 IDO1 (0.42) PPARA
SCHEMBL2090826 0.79 CYP1A2 (0.39) KCNH2CYP1A2GRIK1GRIK2GRIK3
SCHEMBL2091464 0.79 KCNH2 (0.39) KCNH2CYP1A2PPARACYSLTR1GRIK1

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 KCNH2 3503/4885CYP1A2 659/4885PPARA 429/4885

“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.