SCHEMBL5536013

SCHEMBL5536013

O=[C]OCCc1cccc(OCc2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.60
CYP4A11 Q02928 1/20 0.60
BCHE P06276 7/20 0.53
MGLL Q99685 1/20 0.52
MAOB P27338 5/20 0.51
MAOA P21397 1/20 0.51
NR4A2 P43354 1/20 0.51
FFAR1 O14842 2/20 0.51
CYP2D6 P10635 1/20 0.48
LTB4R Q15722 1/20 0.47
LTB4R2 Q9NPC1 1/20 0.47

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
SCHEMBL5536626 0.91 CYP4F2 (0.57) CYP4F2CYP4A11BCHEMGLLMAOB
SCHEMBL5539960 0.90 MGLL (0.59) CYP4F2CYP4A11BCHEMGLLMAOB
SCHEMBL5541860 0.89 FFAR1 (0.52) CYP4F2CYP4A11MAOBMAOAFFAR1
SCHEMBL5542749 0.89 MGLL (0.61) CYP4F2CYP4A11BCHEMGLLMAOB
SCHEMBL5543343 0.89 MGLL (0.61) CYP4F2CYP4A11BCHEMGLLMAOB
SCHEMBL5538042 0.86 BCHE (0.57) CYP4F2CYP4A11BCHEMGLLMAOB
SCHEMBL5543890 0.84 FFAR1 (0.58) BCHEMGLLMAOBFFAR1
SCHEMBL5536450 0.82 FFAR1 (0.58) CYP4F2CYP4A11BCHEMAOBMAOA
SCHEMBL28195807 0.81 CYP4F2 (0.64) CYP4F2CYP4A11BCHEMGLLMAOB
SCHEMBL8192007 0.81 CYP4F2 (0.68) CYP4F2CYP4A11BCHEMGLLMAOB

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 CYP4F2 954/4885CYP4A11 1804/4885BCHE 4833/4885

“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.