SCHEMBL5545918

SCHEMBL5545918

CC1(CN2CCN(c3ccc(Cl)cc3)CC2)CO1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 5/20 0.50
KDM4E B2RXH2 4/20 0.50
GAA P10253 2/20 0.50
LMNA P02545 1/20 0.48
DRD5 P21918 1/20 0.48
MAPT P10636 3/20 0.48
ALDH1A1 P00352 2/20 0.47
DRD2 P14416 3/20 0.46
DRD3 P35462 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KMT2A Q03164 3/20 0.44
GFER P55789 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
MEN1 O00255 1/20 0.44

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
SCHEMBL5545975 0.82 CHRNA7 (0.46) DRD4GAAMAPTALDH1A1DRD2
SCHEMBL5534890 0.81 AKR1C3 (0.45) DRD4DRD2DRD3
SCHEMBL3035707 0.78 DRD2 (0.47) DRD4LMNADRD5MAPTDRD2
SCHEMBL3035705 0.78 DRD2 (0.47) DRD4LMNADRD5MAPTDRD2
SCHEMBL5538491 0.77 KCNH2 (0.44) ALDH1A1DRD2KMT2AMEN1
SCHEMBL5538487 0.77 KCNH2 (0.44) ALDH1A1DRD2KMT2AMEN1
SCHEMBL27859479 0.75 CHRNA7 (0.49) DRD4KDM4EMAPTALDH1A1DRD2
SCHEMBL10891766 0.74 KMT2A (0.71) DRD4KDM4EGAALMNADRD5
SCHEMBL29998630 0.73 HTR3E (0.70) DRD4KDM4EGAALMNAMAPT
SCHEMBL870704 0.73 HTR3E (0.70) DRD4KDM4EGAALMNAMAPT

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 DRD4 368/4885KDM4E 4854/4885GAA 4165/4885

“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.