SCHEMBL5536679

SCHEMBL5536679

O=[C]OCc1c(F)cc(F)cc1F

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP12 P39900 1/20 0.37
IDO1 P14902 4/20 0.31
AGXT P21549 2/20 0.31
RIPK1 Q13546 1/20 0.31
SOD1 P00441 1/20 0.31
CES2 O00748 2/20 0.30
CES1 P23141 2/20 0.30
TAAR1 Q96RJ0 1/20 0.30
MAPK14 Q16539 1/20 0.30

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
SCHEMBL5537730 0.78 MMP1 (0.40) MMP1MMP2MMP9MMP12IDO1
SCHEMBL3251305 0.76 IDO1 (0.52) MMP1MMP2MMP9MMP12IDO1
SCHEMBL96252 0.74 IDO1 (0.58) IDO1AGXTMAPK14
SCHEMBL2093191 0.72 CA12 (0.33) MMP1MMP2MMP9MMP12
SCHEMBL16892293 0.70 TAAR1 (0.39) MMP1MMP2MMP9MMP12IDO1
SCHEMBL25193454 0.70 MMP1 (0.37) MMP1MMP2MMP9MMP12IDO1
SCHEMBL1787181 0.70 MMP1 (0.51) MMP1MMP2MMP9MMP12RIPK1
SCHEMBL98902 0.70 MAOB (0.41) IDO1RIPK1CES2CES1
SCHEMBL5536687 0.70 MMP1 (0.37) MMP1MMP2MMP9MMP12IDO1
SCHEMBL16140133 0.69 MMP1 (0.32) MMP1MMP2MMP9MMP12

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 MMP1 4662/4885MMP2 4704/4885MMP9 4787/4885

“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.