SCHEMBL5539230

SCHEMBL5539230

CC1(Cn2nc(-c3ccc(OC(F)(F)F)cc3)oc2=O)CO1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.43
GAA P10253 1/20 0.40
SCN5A Q14524 3/20 0.38
GRM2 Q14416 1/20 0.37
MAOB P27338 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TRPA1 O75762 1/20 0.36

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
SCHEMBL5542205 0.81 NOTUM (0.54) NOTUMGAA
SCHEMBL5539352 0.77 KCNH2 (0.66) NOTUMGAASCN5A
SCHEMBL5539346 0.77 KCNH2 (0.66) NOTUMGAASCN5A
SCHEMBL5539651 0.67 ALDH1A1 (0.39) GAAMAOBNPSR1TRPA1
SCHEMBL30947369 0.66 KCNH2 (0.48) SCN5AMAOB
SCHEMBL5538487 0.66 KCNH2 (0.44)
SCHEMBL5538491 0.66 KCNH2 (0.44)
SCHEMBL3030444 0.63 HRH3 (0.50) NOTUMSCN5ANPSR1
SCHEMBL1228003 0.62 ALDH1A1 (0.41) GRM2
SCHEMBL5537064 0.61 NOTUM (1.00) NOTUM

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 NOTUM 3827/4885GAA 4165/4885SCN5A 3856/4885

“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.