SCHEMBL5543600

SCHEMBL5543600

CC(O)(COC(=O)N1CC=C(c2cccc(C(F)(F)F)c2)CC1)Cn1cc([N+](=O)[O-])nc1Cl

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 2/20 0.37
CCR2 P41597 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
TRPV1 Q8NER1 6/20 0.35
GRIN2B Q13224 2/20 0.34
GRM5 P41594 1/20 0.34
GRM1 Q13255 1/20 0.34
LNPEP Q9UIQ6 1/20 0.34
SCN9A Q15858 1/20 0.33
LIMK1 P53667 1/20 0.33
LIMK2 P53671 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
KCNK3 O14649 1/20 0.33
HTR7 P34969 1/20 0.33

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
SCHEMBL5543590 1.00 SOS1 (0.37) SOS1CCR2PPARGPPARATRPV1
SCHEMBL5536346 0.92 TRPV1 (0.38) TRPV1
SCHEMBL5536356 0.92 TRPV1 (0.38) TRPV1
SCHEMBL5547380 0.87 GRM5 (0.41) SOS1GRM5GRM1MAPT
SCHEMBL5547376 0.87 GRM5 (0.41) SOS1GRM5GRM1MAPT
SCHEMBL5541962 0.87 ENPP2 (0.38) PPARGPPARAGRM5GRM1MAPT
SCHEMBL5541952 0.87 ENPP2 (0.38) PPARGPPARAGRM5GRM1MAPT
SCHEMBL5537384 0.86 TRPV1 (0.40) PPARGPPARATRPV1SCN9A
SCHEMBL5537389 0.86 TRPV1 (0.40) PPARGPPARATRPV1SCN9A
SCHEMBL5542334 0.86 SIGMAR1 (0.33) GRM5GRM1LNPEPKMT2A

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 SOS1 768/4885CCR2 329/4885PPARG 856/4885

“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.