SCHEMBL5534895

SCHEMBL5534895

[CH2]Cc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.48
MAOB P27338 6/20 0.47
IDO1 P14902 2/20 0.47
LTA4H P09960 2/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
EPHX2 P34913 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
CACNA1B Q00975 1/20 0.43
SCN9A Q15858 3/20 0.41

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
SCHEMBL127709 0.87 TAAR1 (0.54) MAOBIDO1KMT2AEPHX2TAAR1
SCHEMBL5544769 0.85 TAAR1 (0.50) MAPK14MAOBIDO1LTA4HMEN1
SCHEMBL11148692 0.82 CA1 (0.52) MAPK14MAOBIDO1LTA4HSCN9A
SCHEMBL1685383 0.82 CA1 (0.52) MAPK14MAOBIDO1LTA4HSCN9A
SCHEMBL5540313 0.82 TAAR1 (0.47) MAPK14MAOBIDO1LTA4HMEN1
SCHEMBL27900254 0.81 MAOB (0.57) MAOBIDO1TAAR1
SCHEMBL2098374 0.81 LTA4H (0.45) MAPK14MAOBLTA4HSCN9A
SCHEMBL5545036 0.80 LTA4H (0.46) MAPK14MAOBIDO1LTA4HMEN1
SCHEMBL9106039 0.80 SMN1; SMN2 (0.42) MAOBSCN9A
SCHEMBL29377645 0.80 LTA4H (0.50) MAPK14MAOBIDO1LTA4HSCN9A

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
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
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN 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 MAPK14 2803/4885MAOB 2140/4885IDO1 3181/4885

“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.