SCHEMBL6426191

SCHEMBL6426191

Oc1ccc(N2CCC(Nc3ccc(OC(F)(F)C(F)(F)F)cc3)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 3/20 0.41
ME3 Q16798 2/20 0.39
CA12 O43570 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
CA1 P00915 1/20 0.38
ALDH1A1 P00352 2/20 0.38
EPHX2 P34913 5/20 0.38
FAAH O00519 1/20 0.38
AADAC P22760 1/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
EPHX1 P07099 2/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 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
SCHEMBL5544285 0.90 CHRM4 (0.49) CHRM4EPHX2FAAHAADACEPHX1
SCHEMBL5543554 0.88 ALDH1A1 (0.38) CHRM4ALDH1A1EPHX2MAPTEPHX1
SCHEMBL5538171 0.86 KDM4E (0.41) CHRM4ME3CA12CA2CA9
SCHEMBL27610578 0.81 CHRM4 (0.41) CHRM4FAAHTDP1
SCHEMBL5543629 0.81 ME3 (0.41) ME3CA12CA2CA9CA1
SCHEMBL5542619 0.81 ME3 (0.51) ME3CA12CA2CA9CA1
SCHEMBL5542050 0.79 CA12 (0.58) ME3CA12CA2CA9CA1
SCHEMBL5539025 0.79 ME3 (0.43) CHRM4ME3CA12CA2CA9
SCHEMBL5543580 0.78 CHRM4 (0.43) CHRM4EPHX2EPHX1
SCHEMBL5544277 0.78 EPHX2 (0.46) CHRM4EPHX2EPHX1

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 3 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
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed