SCHEMBL5542544

SCHEMBL5542544

CN/C=C/N(C)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.39
KDM4E B2RXH2 1/20 0.35
TGM2 P21980 1/20 0.34
OPRM1 P35372 2/20 0.33
OPRL1 P41146 2/20 0.33
PYCR1 P32322 1/20 0.33
GAA P10253 1/20 0.32
EPHX2 P34913 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
SCHEMBL2095096 0.73 KIF11 (0.47) KIF11OPRM1OPRL1PYCR1GAA
SCHEMBL5543929 0.71 KIF11 (0.36) KIF11KDM4EOPRM1OPRL1PYCR1
SCHEMBL5543933 0.71 KIF11 (0.36) KIF11KDM4EOPRM1OPRL1PYCR1
SCHEMBL13367596 0.69 KIF11 (0.50) KIF11OPRM1OPRL1PYCR1
SCHEMBL2056226 0.69 SLC2A1 (0.58) KIF11OPRM1OPRL1PYCR1GAA
SCHEMBL5428267 0.69 KIF11 (0.56) KIF11
SCHEMBL18685866 0.66 KIF11 (0.52) KIF11OPRM1OPRL1PYCR1
SCHEMBL21965753 0.65 KIF11 (0.50) KIF11OPRM1OPRL1PYCR1
SCHEMBL11671967 0.65 KIF11 (0.59) KIF11
SCHEMBL23804581 0.64 MLYCD (0.49) KIF11EPHX2

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 KIF11 3946/4885KDM4E 4854/4885TGM2 3103/4885

“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.