SCHEMBL5537422

SCHEMBL5537422

O=C(O)NCC1Cn2cc([N+](=O)[O-])nc2O1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 3/20 0.34
KMT2A Q03164 3/20 0.33
GAA P10253 1/20 0.33
MITF O75030 1/20 0.33
POLB P06746 1/20 0.32
PKM P14618 1/20 0.32
KCNH2 Q12809 4/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL1229247 0.83 CHRM1 (0.42) CHRM1ALDH1A1MITFPKMKCNH2
SCHEMBL5541985 0.81 CHRM1 (0.40) CHRM1ALDH1A1MITFPKMKCNH2
SCHEMBL18031624 0.79 CHRM1 (0.41) CHRM1ALDH1A1MITFPKMKCNH2
SCHEMBL14775274 0.77 CHRM1 (0.39) CHRM1ALDH1A1MITFKCNH2
SCHEMBL5538961 0.77 CHRM1 (0.35) CHRM1ALDH1A1KMT2AKCNH2
SCHEMBL5540324 0.77 CHRM1 (0.35) CHRM1ALDH1A1KMT2AKCNH2
SCHEMBL5538952 0.77 CHRM1 (0.35) CHRM1ALDH1A1KMT2AKCNH2
SCHEMBL1228993 0.74 CHRM1 (0.38) CHRM1ALDH1A1MITFPOLBKCNH2
SCHEMBL22527399 0.73 GRM2 (0.40) CHRM1KMT2A
SCHEMBL5539431 0.73 CHRM1 (0.44) CHRM1ALDH1A1MITFKCNH2

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 CHRM1 463/4885L3MBTL1 1931/4885ALDH1A1 355/4885

“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.