SCHEMBL5542334

SCHEMBL5542334

C[C@](O)(COC(=O)N1CC=C(c2ccc(Br)cc2)CC1)Cn1cc([N+](=O)[O-])nc1Cl

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.33
ENPP2 Q13822 1/20 0.33
GRM1 Q13255 8/20 0.33
GRM5 P41594 7/20 0.33
NAMPT P43490 2/20 0.33
LNPEP Q9UIQ6 1/20 0.32
GPR119 Q8TDV5 2/20 0.32
SUV39H2 Q9H5I1 2/20 0.32
GCGR P47871 1/20 0.32
KMT2A Q03164 1/20 0.31
TLR7 Q9NYK1 1/20 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
SCHEMBL5542342 1.00 SIGMAR1 (0.33) SIGMAR1ENPP2GRM1GRM5NAMPT
SCHEMBL5541952 0.94 ENPP2 (0.38) ENPP2GRM1GRM5NAMPTKMT2A
SCHEMBL5541962 0.94 ENPP2 (0.38) ENPP2GRM1GRM5NAMPTKMT2A
SCHEMBL5547376 0.92 GRM5 (0.41) SIGMAR1ENPP2GRM1GRM5TLR7
SCHEMBL5547380 0.92 GRM5 (0.41) SIGMAR1ENPP2GRM1GRM5TLR7
SCHEMBL5544836 0.91 GRM1 (0.35) ENPP2GRM1GRM5NAMPTGPR119
SCHEMBL5544841 0.91 GRM1 (0.35) ENPP2GRM1GRM5NAMPTGPR119
SCHEMBL5536346 0.91 TRPV1 (0.38)
SCHEMBL5536356 0.91 TRPV1 (0.38)
SCHEMBL5537389 0.89 TRPV1 (0.40) GPR119

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 SIGMAR1 234/4885ENPP2 2915/4885GRM1 169/4885

“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.