SCHEMBL5539512

SCHEMBL5539512

CC1(Cn2nc(-c3ccc(-c4ccccc4)cc3)oc2=O)CO1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 7/20 0.44
GRIN2B Q13224 7/20 0.44
FAAH O00519 1/20 0.42
MGLL Q99685 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAOB P27338 2/20 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
SCHEMBL5536702 0.97 GRIN1 (0.46) GRIN1GRIN2BFAAHMGLLKDM4E
SCHEMBL5540085 0.87 GAA (0.53) GRIN1GRIN2BMAOB
SCHEMBL5542205 0.87 NOTUM (0.54) GRIN1GRIN2BKDM4EHPGD
SCHEMBL5535013 0.84 NOTUM (0.40) GRIN1GRIN2BKDM4EKMT2A
SCHEMBL10703697 0.75 KDM4E (0.51) GRIN1GRIN2BFAAHMGLLKDM4E
SCHEMBL5540846 0.74 KCNH2 (0.48) GRIN1GRIN2BKMT2ASMN1; SMN2
SCHEMBL11871352 0.72 KDM4E (0.51) GRIN1GRIN2BKDM4EHPGDKMT2A
SCHEMBL5540024 0.72 TSPO (0.46)
SCHEMBL5543717 0.71 KCNH2 (0.47) GRIN1GRIN2BKDM4EHPGDKMT2A
SCHEMBL10703330 0.71 FAAH (0.57) GRIN1GRIN2BFAAHMGLLKDM4E

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 GRIN1 289/4885GRIN2B 504/4885FAAH 4363/4885

“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.