SCHEMBL5539508

SCHEMBL5539508

[CH2]Cc1ncc(CCCCC)o1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 2/20 0.33
MAPT P10636 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KCNH2 Q12809 1/20 0.32
MGAT2 Q10469 1/20 0.31
EPHX2 P34913 1/20 0.31
PPARA Q07869 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
SCHEMBL5546363 0.98 MAPT (0.35) TLR7MAPTKCNH2MGAT2EPHX2
SCHEMBL5539286 0.95 TLR8 (0.36) MAPTTLR8TDP1L3MBTL1
SCHEMBL5541496 0.88 TLR7 (0.32) TLR7MAPTTLR8TDP1L3MBTL1
SCHEMBL2062290 0.87 PPARA (0.36) TLR7MAPTTLR8TDP1L3MBTL1
SCHEMBL5541741 0.87 TLR8 (0.33) TLR8
SCHEMBL5540375 0.86 MAPT (0.34) TLR7MAPTKCNH2MGAT2EPHX2
SCHEMBL5537436 0.86 MGAT2 (0.32) TLR7MAPTTLR8TDP1L3MBTL1
SCHEMBL5540329 0.85 MGAT2 (0.34) TLR7MAPTKCNH2MGAT2EPHX2
SCHEMBL11646525 0.82 TLR7 (0.36) TLR7MAPTTLR8TDP1L3MBTL1
SCHEMBL5538836 0.82 TLR8 (0.36) TLR8

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 TLR7 756/4885MAPT 4117/4885TLR8 1198/4885

“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.