SCHEMBL5539260

SCHEMBL5539260

O=C1[N]CCN1Cc1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
POLB P06746 1/20 0.56
RAB9A P51151 1/20 0.51
TP53 P04637 1/20 0.43
HTT P42858 2/20 0.43
NPC1 O15118 1/20 0.43
GRM2 Q14416 2/20 0.42
KCNH2 Q12809 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
HDAC1 Q13547 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL5543146 0.84 ERCC1 (0.46) ALDH1A1HTTGRM2KCNH2LMNA
SCHEMBL9704138 0.83 ERCC1 (0.39) KCNH2
SCHEMBL5547200 0.83 ALDH1A1 (0.37) ALDH1A1POLBRAB9A
SCHEMBL5540694 0.83 ALDH1A1 (0.42) ALDH1A1POLBHTTGRM2HDAC1
SCHEMBL5251526 0.82 DDB1 (0.49) ALDH1A1POLBKCNH2THRBL3MBTL1
SCHEMBL5547283 0.82 ALDH1A1 (0.49) ALDH1A1POLBHTTL3MBTL1
SCHEMBL5548109 0.81 ALDH1A1 (0.50) ALDH1A1POLBSMN1; SMN2L3MBTL1MEN1
SCHEMBL5537759 0.79 POLB (0.49) ALDH1A1POLBTP53KCNH2MAPT
SCHEMBL5536668 0.79 GAA (0.55) ALDH1A1POLBGRM2MAPTHDAC1
SCHEMBL5543388 0.78 ALDH1A1 (0.33) ALDH1A1POLBRAB9AMAPT

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 ALDH1A1 355/4885POLB 1637/4885RAB9A 2824/4885

“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.