SCHEMBL5542283

SCHEMBL5542283

O=[C]OCc1ccccc1SC(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 13/20 0.52
FFAR1 O14842 5/20 0.48
NTRK1 P04629 2/20 0.35
SLC6A2 P23975 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
IDO1 P14902 2/20 0.32
HCAR1 Q9BXC0 1/20 0.31

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
SCHEMBL5546179 0.84 FFAR4 (0.44) FFAR4FFAR1NTRK1SLC6A2ALDH1A1
SCHEMBL515494 0.77 ALDH1A1 (0.47) SLC6A2ALDH1A1PKMHPGDL3MBTL1
SCHEMBL1715944 0.77 IDO1 (0.55) FFAR4FFAR1IDO1
SCHEMBL5542287 0.77 FFAR4 (0.52) FFAR4FFAR1NTRK1SLC6A2ALDH1A1
Hydrochloric Acid SCHEMBL1715862 0.76 IDO1 (0.56) FFAR4FFAR1IDO1
SCHEMBL6762797 0.74 FFAR4 (0.49) FFAR4FFAR1NTRK1SLC6A2ALDH1A1
SCHEMBL12361207 0.74 FFAR4 (0.49) FFAR4FFAR1NTRK1SLC6A2ALDH1A1
SCHEMBL2091827 0.74 IDO1 (0.59) FFAR4FFAR1ALDH1A1IDO1
SCHEMBL5539587 0.71 IDO1 (0.43) FFAR4FFAR1IDO1
SCHEMBL2090202 0.71 HDAC3 (0.40) FFAR1SLC6A2

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 FFAR4 338/4885FFAR1 105/4885NTRK1 777/4885

“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.