SCHEMBL5545898

SCHEMBL5545898

[CH2]c1ccccc1OC1CCCCO1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.37
PDE4B Q07343 2/20 0.34
DHFR P00374 1/20 0.34
PTPN1 P18031 2/20 0.34
HRH3 Q9Y5N1 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
SLC6A3 Q01959 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
TNK2 Q07912 1/20 0.30

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
SCHEMBL6342508 0.88 KDM4C (0.41) KDM4CPDE4BDHFRPTPN1HRH3
SCHEMBL30788461 0.88 KDM4C (0.41) KDM4CPDE4BDHFRPTPN1HRH3
SCHEMBL30900819 0.80 KDM4C (0.37) KDM4CPDE4BDHFRPTPN1MEN1
SCHEMBL1423598 0.80 KDM4C (0.37) KDM4CPDE4BDHFRPTPN1HRH3
SCHEMBL954903 0.80 HPGD (0.38) KDM4CPDE4BDHFRPTPN1MEN1
SCHEMBL8067831 0.80 KDM4C (0.37) KDM4CPDE4BDHFRPTPN1HRH3
SCHEMBL1680042 0.80 KDM4C (0.37) KDM4CPDE4BDHFRPTPN1MEN1
SCHEMBL7774635 0.80 SLC6A2 (0.39) KDM4CMEN1KMT2AL3MBTL1SLC6A3
SCHEMBL7241320 0.80 ALDH1A1 (0.44) PDE4BMEN1KMT2ASLC6A3
SCHEMBL12429188 0.80 SLC6A4 (0.44) KDM4CL3MBTL1SLC6A3

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
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
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN 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 KDM4C 4636/4885PDE4B 3738/4885DHFR 180/4885

“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.