SCHEMBL5543882

SCHEMBL5543882

CC1Cc2c([O])cccc2O1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.45
CREBBP Q92793 1/20 0.45
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
MAPT P10636 2/20 0.44
MAOA P21397 6/20 0.42
MAOB P27338 5/20 0.39
KDM4E B2RXH2 3/20 0.38
POLL Q9UGP5 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
POLB P06746 1/20 0.37
PBRM1 Q86U86 1/20 0.37
TSHR P16473 1/20 0.36
PARP1 P09874 3/20 0.36

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
SCHEMBL7947753 0.78 KDM4E (0.47) BRD4CREBBPALDH1A1HPGDMAPT
SCHEMBL1285321 0.77 PARP1 (0.45) BRD4CREBBPALDH1A1HPGDMAPT
SCHEMBL13894882 0.77 AKR1B1 (0.42) BRD4CREBBPALDH1A1HPGDMAPT
SCHEMBL3694108 0.77 BRD4 (0.41) BRD4CREBBPALDH1A1HPGDMAPT
SCHEMBL1284896 0.77 MAOA (0.54) BRD4CREBBPALDH1A1HPGDMAPT
SCHEMBL5542883 0.77 MAOA (0.44) ALDH1A1HPGDMAPTMAOAKDM4E
SCHEMBL6681925 0.77 ALDH1A1 (0.44) BRD4CREBBPALDH1A1HPGDMAPT
SCHEMBL20483902 0.75 DRD2 (0.48) BRD4CREBBPALDH1A1HPGDMAPT
SCHEMBL13266254 0.75 TDP1 (0.46) BRD4CREBBPALDH1A1HPGDMAPT
SCHEMBL4596846 0.73 KDM4E (0.43) BRD4CREBBPALDH1A1HPGDMAPT

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 BRD4 1012/4885CREBBP 1702/4885ALDH1A1 355/4885

“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.