SCHEMBL5541829

SCHEMBL5541829

FC(F)(F)Oc1ccc(CCCOc2cc[c]cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.43
FFAR1 O14842 3/20 0.41
PPARA Q07869 2/20 0.40
DAO P14920 1/20 0.40
SCN8A Q9UQD0 1/20 0.39
FFAR4 Q5NUL3 1/20 0.38
HRH3 Q9Y5N1 2/20 0.38
GPR84 Q9NQS5 1/20 0.38
HRH2 P25021 1/20 0.38
HRH1 P35367 1/20 0.38
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
MAOB P27338 1/20 0.37
AOC3 Q16853 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL5542134 0.95 FFAR1 (0.42) PPARGFFAR1PPARADAOSCN8A
SCHEMBL5545379 0.94 FFAR1 (0.41) PPARGFFAR1DAOSCN8AFFAR4
SCHEMBL5539330 0.92 PPARG (0.43) PPARGFFAR1PPARADAOFFAR4
SCHEMBL5541812 0.83 MAOB (0.48) PPARAMAOB
SCHEMBL5543284 0.82 CHRM2 (0.46) PPARGFFAR1PPARADAOMAOB
SCHEMBL5545066 0.82 PTPRZ1 (0.49) MAOB
SCHEMBL5540879 0.80 MAOB (0.44) FFAR1MAOB
SCHEMBL5545414 0.79 MAPT (0.40) DAOSCN8AGPR84SLC6A4SLC6A3
SCHEMBL9061106 0.79 LMNA (0.48) PPARGDAOSCN8AHRH3ALDH1A1
SCHEMBL5537763 0.78 MAOB (0.47) FFAR1PPARAMAOB

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 PPARG 856/4885FFAR1 105/4885PPARA 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.