SCHEMBL5543804

SCHEMBL5543804

O=COCCCCc1nccs1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.36
CHRM2 P08172 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
SLC6A3 Q01959 3/20 0.32
LTA4H P09960 1/20 0.31
PLA2G4A P47712 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP2C19 P33261 1/20 0.31
SIGMAR1 Q99720 1/20 0.30
CES1 P23141 1/20 0.30
DRD4 P21917 1/20 0.30

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
SCHEMBL5537184 0.98 FDPS (0.35) FDPSCHRM2CHRM1CHRM3SLC6A3
SCHEMBL5542113 0.98 FDPS (0.35) FDPSCHRM2CHRM1CHRM3SLC6A3
SCHEMBL5544438 0.95 FDPS (0.37) FDPSCHRM2CHRM1CHRM3SLC6A3
SCHEMBL5542821 0.88 FDPS (0.39) FDPSCHRM2CHRM1CHRM3SLC6A3
Ethoxycarbonyl Group SCHEMBL27739581 0.81 L3MBTL1 (0.38) FDPSCHRM2CHRM1CHRM3SLC6A3
SCHEMBL2091120 0.77 FDPS (0.39) FDPSCHRM2CHRM1CHRM3SLC6A3
SCHEMBL2091117 0.77 FDPS (0.35) FDPSCHRM2CHRM1CHRM3SLC6A3
SCHEMBL324559 0.77
SCHEMBL5543803 0.77 FDPS (0.36) FDPSCHRM2CHRM1CHRM3SLC6A3
SCHEMBL5542101 0.75 FDPS (0.35) FDPSCHRM2CHRM1CHRM3SLC6A3

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 FDPS 1781/4885CHRM2 862/4885CHRM1 463/4885

“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.