SCHEMBL5544950

SCHEMBL5544950

O=COCCCCCc1ccc([N+](=O)[O-])o1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.45
MAPT P10636 5/20 0.40
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 2/20 0.40
NPC1 O15118 2/20 0.40
MITF O75030 2/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
MEN1 O00255 1/20 0.40
XBP1 P17861 1/20 0.40
RAB9A P51151 1/20 0.40
HPGD P15428 1/20 0.37
POLB P06746 3/20 0.36
GLO1 Q04760 1/20 0.35
TP53 P04637 1/20 0.34
CASP6 P55212 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL5538594 1.00 LMNA (0.45) LMNAMAPTKMT2ATDP1L3MBTL1
SCHEMBL5536699 0.99 LMNA (0.46) LMNAMAPTKMT2ATDP1L3MBTL1
SCHEMBL5539128 0.94 LMNA (0.47) LMNAMAPTKMT2ATDP1L3MBTL1
SCHEMBL5536805 0.88 LMNA (0.50) LMNAMAPTKMT2ATDP1L3MBTL1
SCHEMBL5538590 0.80 LMNA (0.45) LMNAMAPTKMT2ATDP1L3MBTL1
SCHEMBL5544946 0.80 LMNA (0.45) LMNAMAPTKMT2ATDP1L3MBTL1
SCHEMBL5536694 0.78 LMNA (0.46) LMNAMAPTKMT2ATDP1L3MBTL1
SCHEMBL23394749 0.77 LMNA (0.51) LMNAMAPTKMT2ATDP1L3MBTL1
SCHEMBL18476728 0.77 LMNA (0.51) LMNAMAPTKMT2ATDP1L3MBTL1
SCHEMBL22504349 0.77 LMNA (0.51) LMNAMAPTKMT2ATDP1L3MBTL1

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 LMNA 4152/4885MAPT 4117/4885KMT2A 4267/4885

“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.