SCHEMBL5542403

SCHEMBL5542403

CCN1C(=O)[N]c2cc(F)ccc21

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 5/20 0.51
PAK1 Q13153 1/20 0.41
PKN1 Q16512 1/20 0.41
GRIA2 P42262 4/20 0.38
GRIA1 P42261 3/20 0.38
GRIA3 P42263 3/20 0.38
GRIA4 P48058 3/20 0.38
BRD4 O60885 3/20 0.34
MPO P05164 1/20 0.33
ATAD2 Q6PL18 1/20 0.33
S1PR4 O95977 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR5 Q9H228 1/20 0.32
TRPA1 O75762 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL5542614 0.82 PTGS1 (0.41) PARK7
SCHEMBL5544093 0.78 ALDH1A1 (0.36) PARK7ATAD2MAPT
SCHEMBL5534874 0.77 GRIA2 (0.38) PARK7PAK1PKN1GRIA2GRIA1
SCHEMBL4753186 0.75 ALDH1A1 (0.41) MAPT
SCHEMBL7436460 0.75 ALDH1A1 (0.41) MAPT
SCHEMBL5545351 0.73 PARK7 (0.34) PARK7GRIA2GRIA1GRIA3GRIA4
SCHEMBL20254404 0.68 PARK7 (1.00) PARK7
SCHEMBL5545985 0.67 SRD5A1 (0.36) PARK7GRIA2GRIA1GRIA3GRIA4
SCHEMBL11529967 0.67 BRD4 (0.55) PARK7PAK1PKN1GRIA2BRD4
SCHEMBL20248930 0.66 PARK7 (0.71) PARK7PAK1PKN1BRD4TRPA1

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 PARK7 4015/4885PAK1 2731/4885PKN1 4112/4885

“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.