SCHEMBL5543359

SCHEMBL5543359

O=[C]OCc1ncc(-c2ccccc2F)s1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 2/20 0.34
ERCC5 P28715 1/20 0.34
STK17B O94768 1/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPK14 Q16539 3/20 0.33
ESRRG P62508 2/20 0.33
ALOX5AP P20292 1/20 0.32
NPC1 O15118 1/20 0.32
CTSA P10619 3/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP1B1 Q16678 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.31
MET P08581 1/20 0.31
NOTUM Q6P988 1/20 0.31

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
SCHEMBL5536697 0.83 ALDH1A1 (0.41) FEN1ALDH1A1ALOX5APCTSANOTUM
SCHEMBL5541402 0.80 ERCC5 (0.54) FEN1ERCC5LOXL2
SCHEMBL5539232 0.76 KDM4E (0.42) STK17BKDM4EALDH1A1NPC1NOTUM
SCHEMBL5544619 0.69 MAPK14 (0.38) KDM4EALDH1A1MAPK14NPC1NOTUM
SCHEMBL5539077 0.69 MAPK14 (0.35) KDM4EALDH1A1MAPK14NOTUM
SCHEMBL5546252 0.69 KDM4E (0.43) KDM4ECTSA
SCHEMBL5539618 0.67 SLC6A3 (0.39) NPC1
SCHEMBL5536337 0.67 CASR (0.42) FEN1KDM4EALDH1A1MAPK14ALOX5AP
SCHEMBL2404342 0.67 ALDH1A1 (0.53) FEN1KDM4EALDH1A1MAPK14ALOX5AP
SCHEMBL29993395 0.67 ALDH1A1 (0.53) FEN1KDM4EALDH1A1MAPK14ALOX5AP

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
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 FEN1 3996/4885ERCC5 4470/4885STK17B 1420/4885

“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.