SCHEMBL5541396

SCHEMBL5541396

O=[C]OCc1ccc(Cl)c(C(F)(F)C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.49
MAOB P27338 1/20 0.36
PYCR1 P32322 1/20 0.36
KDM4C Q9H3R0 1/20 0.35
MRGPRX4 Q96LA9 3/20 0.35
ABCB11 O95342 1/20 0.34
SLC6A4 P31645 1/20 0.34
GPR84 Q9NQS5 1/20 0.33
PTGDR2 Q9Y5Y4 2/20 0.32
MGLL Q99685 1/20 0.32
PTGER1 P34995 1/20 0.32
KDM4A O75164 1/20 0.31
KDM5A P29375 1/20 0.31
KDM5B Q9UGL1 1/20 0.31
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31

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
SCHEMBL5542677 0.88 IDO1 (0.39) IDO1MRGPRX4MGLL
SCHEMBL5541400 0.79 IDO1 (0.49) IDO1MAOBPYCR1KDM4CMRGPRX4
SCHEMBL95625 0.77 IDO1 (0.57) IDO1MAOB
SCHEMBL2091499 0.76 IDO1 (0.39) IDO1MRGPRX4KDM5AKDM5BPPARG
SCHEMBL5540223 0.74 IDO1 (0.40) IDO1MAOB
SCHEMBL5548454 0.74 MRGPRX4 (0.36) IDO1MRGPRX4PTGDR2
SCHEMBL5536259 0.73 PTPN7 (0.43) IDO1SLC6A4
SCHEMBL5547877 0.73 SCN3A (0.43) MRGPRX4PTGDR2
SCHEMBL5541818 0.72 IDO1 (0.46) IDO1MAOB
SCHEMBL2091880 0.72 IDO1 (0.41) IDO1MAOB

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 IDO1 3181/4885MAOB 2140/4885PYCR1 783/4885

“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.