SCHEMBL5536692

SCHEMBL5536692

O=[C]OCC=Cc1cccc(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.47
CYP2C9 P11712 1/20 0.47
FBP1 P09467 1/20 0.45
RELA Q04206 1/20 0.44
GRIK1 P39086 1/20 0.44
GRIK2 Q13002 1/20 0.44
NFE2L2 Q16236 3/20 0.43
MAOB P27338 5/20 0.42
CHAT P28329 1/20 0.41
CHRM5 P08912 1/20 0.41
MAOA P21397 3/20 0.40
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
AKR1C3 P42330 1/20 0.39
CYP1A1 P04798 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP1B1 Q16678 1/20 0.38

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
SCHEMBL5536691 1.00 CYP1A2 (0.47) CYP1A2CYP2C9FBP1RELAGRIK1
SCHEMBL5536010 0.83 AHR (0.39) CYP2C19
SCHEMBL5536015 0.83 AHR (0.39) CYP2C19
SCHEMBL5545874 0.81 RELA (0.45) FBP1RELAMAOBMAOA
SCHEMBL5543977 0.81 HSD17B3 (0.47) MAOBMAOACYP2D6CYP1B1
SCHEMBL5546282 0.81 NFE2L2 (0.53) CYP1A2FBP1RELANFE2L2CHRM5
SCHEMBL5543980 0.81 HSD17B3 (0.47) MAOBMAOACYP2D6CYP1B1
SCHEMBL5546280 0.81 NFE2L2 (0.53) CYP1A2FBP1RELANFE2L2CHRM5
SCHEMBL5545876 0.81 RELA (0.45) FBP1RELAMAOBMAOA
SCHEMBL5544290 0.80 CYP1A2 (0.41) CYP1A2FBP1GRIK1GRIK2NFE2L2

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 CYP1A2 659/4885CYP2C9 2351/4885FBP1 1110/4885

“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.