SCHEMBL5539447

SCHEMBL5539447

[CH2]C=Cc1c(F)cc(F)cc1F

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.32
PTP4A3 O75365 1/20 0.32
NFE2L2 Q16236 2/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 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
SCHEMBL5539442 1.00 ERN1 (0.32) ERN1PTP4A3NFE2L2CES2CES1
SCHEMBL15145958 0.74 ERN1 (0.32) ERN1PTP4A3NFE2L2CES2CES1
SCHEMBL3193831 0.74 ERN1 (0.32) ERN1PTP4A3NFE2L2CES2CES1
SCHEMBL320358 0.72 ERN1 (0.34) ERN1PTP4A3CES2CES1
SCHEMBL2091124 0.71 ERN1 (0.37) ERN1PTP4A3NFE2L2CES2CES1
SCHEMBL2094779 0.70 PTGS1 (0.46) NFE2L2CES2CES1
SCHEMBL2094782 0.70 PTGS1 (0.46) NFE2L2CES2CES1
SCHEMBL21676194 0.70 ERN1 (0.39) ERN1PTP4A3CES2CES1
SCHEMBL1673714 0.69 NQO2 (0.31) NFE2L2
SCHEMBL1689618 0.69 NFE2L2 (0.61) NFE2L2

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
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
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
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed