SCHEMBL5542228

SCHEMBL5542228

O=[C]OCCc1cc2cccc(F)c2o1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
L3MBTL1 Q9Y468 4/20 0.35
ATM Q13315 2/20 0.35
MKNK1 Q9BUB5 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
F2RL3 Q96RI0 2/20 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
SCHEMBL5535130 0.89 CA12 (0.37) CA12CA1CA2CA9L3MBTL1
SCHEMBL5540946 0.85 CA12 (0.42) CA12CA1CA2CA9MKNK1
SCHEMBL5537327 0.83 ATM (0.32) L3MBTL1ATMTDP1
SCHEMBL5540396 0.77 PPARG (0.35) L3MBTL1ATMMKNK1F2RL3
SCHEMBL28045961 0.75 CA12 (0.43) CA12CA1CA2CA9F2RL3
SCHEMBL5537651 0.73 MAPT (0.36)
SCHEMBL5541845 0.72 L3MBTL1 (0.36) CA12CA1CA9L3MBTL1ATM
SCHEMBL5542277 0.72 CA12 (0.38) CA12CA1CA2CA9L3MBTL1
SCHEMBL1287389 0.72 CA12 (0.45) CA12CA1CA2CA9MKNK1
SCHEMBL2304012 0.72 CA12 (0.45) CA12CA1CA2CA9MKNK1

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 CA12 1998/4885CA1 3493/4885CA2 1853/4885

“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.