SCHEMBL5543200

SCHEMBL5543200

N#Cc1ccc(N2CCN(C[C@H](O)Cn3cc([N+](=O)[O-])nc3Cl)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
MAPT P10636 4/20 0.44
HTT P42858 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 3/20 0.40
KCNH2 Q12809 2/20 0.39
NPY1R P25929 1/20 0.39
NPY2R P49146 1/20 0.39
LMNA P02545 2/20 0.39
IGF1R P08069 1/20 0.39
HTR7 P34969 2/20 0.39
ACHE P22303 1/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 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
SCHEMBL5543208 1.00 TDP1 (0.46) TDP1MAPTHTTALDH1A1KMT2A
SCHEMBL5543102 0.87 MAPT (0.47) TDP1MAPTHTTALDH1A1KMT2A
SCHEMBL5543095 0.87 MAPT (0.47) TDP1MAPTHTTALDH1A1KMT2A
SCHEMBL5535190 0.85 CACNA1G (0.48) TDP1MAPTHTTALDH1A1KCNH2
SCHEMBL5535186 0.85 CACNA1G (0.48) TDP1MAPTHTTALDH1A1KCNH2
SCHEMBL5542335 0.77 LMNA (0.40) TDP1ALDH1A1KMT2ALMNAACHE
SCHEMBL5535927 0.77 LMNA (0.40) TDP1ALDH1A1KMT2ALMNAACHE
SCHEMBL5535923 0.77 LMNA (0.40) TDP1ALDH1A1KMT2ALMNAACHE
SCHEMBL6010797 0.72 ABCB1 (0.44) MAPTHTTALDH1A1KMT2AKCNH2
SCHEMBL5535042 0.72 ABCB1 (0.44) MAPTHTTALDH1A1KMT2AKCNH2

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 TDP1 4666/4885MAPT 4117/4885HTT 4644/4885

“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.