SCHEMBL5537217

SCHEMBL5537217

COc1ccc(N2CCN(C(=O)OCC(C)(O)Cn3cc([N+](=O)[O-])nc3Cl)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.46
ALDH1A1 P00352 5/20 0.44
GAA P10253 1/20 0.44
LMNA P02545 6/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
TDP1 Q9NUW8 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
TP53 P04637 1/20 0.40
ENPP2 Q13822 1/20 0.40

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
SCHEMBL5537206 1.00 MAPT (0.46) MAPTALDH1A1GAALMNASMN1; SMN2
SCHEMBL5546006 0.92 LMNA (0.46) MAPTALDH1A1GAALMNASMN1; SMN2
SCHEMBL5546002 0.92 LMNA (0.46) MAPTALDH1A1GAALMNASMN1; SMN2
SCHEMBL5536156 0.91 PTGS1 (0.43) MAPTALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL5536163 0.91 PTGS1 (0.43) MAPTALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL5542473 0.91 MAPT (0.45) MAPTALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL5542481 0.91 MAPT (0.45) MAPTALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL5534954 0.89 ENPP2 (0.45) MAPTALDH1A1LMNASMN1; SMN2NPSR1
SCHEMBL5534947 0.89 ENPP2 (0.45) MAPTALDH1A1LMNASMN1; SMN2NPSR1
SCHEMBL5546105 0.89 MAPT (0.53) MAPTALDH1A1LMNASMN1; SMN2MAPK1

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
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 MAPT 4117/4885ALDH1A1 355/4885GAA 4165/4885

“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.