SCHEMBL5537500

SCHEMBL5537500

O=CNCCCCCCc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 1/20 0.47
EPHX2 P34913 4/20 0.43
LTA4H P09960 1/20 0.43
GPR84 Q9NQS5 1/20 0.43
TRPV1 Q8NER1 4/20 0.42
DAO P14920 1/20 0.42
SCN8A Q9UQD0 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
NR1H4 Q96RI1 1/20 0.40
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL5541752 0.95 SLC6A5 (0.46) SLC6A5EPHX2LTA4HGPR84TRPV1
SCHEMBL3889241 0.89 EPHX2 (0.49) SLC6A5EPHX2LTA4HGPR84TRPV1
SCHEMBL5546121 0.84 GPR84 (0.45) SLC6A5EPHX2LTA4HGPR84DAO
SCHEMBL5546757 0.84 SLC6A5 (0.37) SLC6A5EPHX2LTA4HGPR84TRPV1
SCHEMBL5536523 0.83 GPR84 (0.46) SLC6A5EPHX2LTA4HGPR84DAO
SCHEMBL5537176 0.81 GPR84 (0.47) SLC6A5EPHX2LTA4HGPR84DAO
SCHEMBL5537488 0.81 SLC6A5 (0.44) SLC6A5EPHX2LTA4HGPR84TRPV1
SCHEMBL5542719 0.80 HDAC1 (0.53) SLC6A5HDAC1SIGMAR1
SCHEMBL5540875 0.80 HDAC1 (0.53) SLC6A5HDAC1SIGMAR1
SCHEMBL514072 0.79 ADH1B (0.50) EPHX2SCN8AHDAC3HDAC1HDAC2

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 SLC6A5 4639/4885EPHX2 3662/4885LTA4H 3452/4885

“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.