SCHEMBL5543426

SCHEMBL5543426

O=[C]OCCCCCCc1cc2c(F)cccc2o1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 13/20 0.35
MTNR1B P49286 13/20 0.35
HTR2B P41595 2/20 0.34
PPARG P37231 1/20 0.33
MKNK1 Q9BUB5 1/20 0.32
STS P08842 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL5540396 0.89 PPARG (0.35) MTNR1AMTNR1BHTR2BPPARGMKNK1
SCHEMBL5536540 0.87 MTNR1A (0.35) MTNR1AMTNR1BHTR2BPPARGSTS
SCHEMBL5542667 0.81 AGXT (0.34) HTR2BPPARGMKNK1
SCHEMBL5535130 0.80 CA12 (0.37) MKNK1
SCHEMBL5542824 0.79 AGXT (0.45) HTR2B
SCHEMBL5539271 0.76 PPARG (0.35) MTNR1AMTNR1BHTR2BPPARG
SCHEMBL5545088 0.75 L3MBTL1 (0.34) HTR2B
SCHEMBL5540512 0.75 CA12 (0.35) HTR2BMKNK1
SCHEMBL28615153 0.75 ALOX15 (0.43) MTNR1AMTNR1BHTR2BSTSALOX15
SCHEMBL27629315 0.73

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 MTNR1A 1560/4885MTNR1B 1562/4885HTR2B 3791/4885

“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.