SCHEMBL2091125

SCHEMBL2091125

O=[C]C/C=C/c1ccc(Br)cc1F

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 1/20 0.37
DGAT1 O75907 1/20 0.35
MIF P14174 1/20 0.33
NFE2L2 Q16236 3/20 0.33
PYCR1 P32322 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
PDPK1 O15530 1/20 0.31
NTSR1 P30989 1/20 0.30
KDM1A O60341 1/20 0.30
KDM1B Q8NB78 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
SCHEMBL2091127 1.00 GPR183 (0.37) GPR183DGAT1MIFNFE2L2PYCR1
SCHEMBL5544818 0.83 MAPK1 (0.35)
SCHEMBL2095517 0.83 NFE2L2 (0.50) NFE2L2
SCHEMBL5544821 0.83 MAPK1 (0.35)
SCHEMBL2095515 0.83 NFE2L2 (0.50) NFE2L2
SCHEMBL2089425 0.81 GPR183 (0.39) GPR183DGAT1MIFNFE2L2PDPK1
SCHEMBL2089427 0.81 GPR183 (0.39) GPR183DGAT1MIFNFE2L2PDPK1
SCHEMBL5546541 0.80 GPR183 (0.35) GPR183DGAT1MIFNFE2L2PYCR1
SCHEMBL5546545 0.80 GPR183 (0.35) GPR183DGAT1MIFNFE2L2PYCR1
SCHEMBL2091129 0.79 GPR183 (0.39) GPR183DGAT1MIFNFE2L2PDPK1

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
US-8163753-B2 2-(4-(4-(4-chlorophenyl)oxazol-2-yl)phenoxymethyl)-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole; bactericide; excellent bactericidal action against Mycobacterium tuberculosis, multi-drug-resistant Mycobacterium tuberculosis, and atypical acid-fast bacteria OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-04-24 US disclosed
EP-1678185-B1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2008-10-08 EP disclosed
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis OTSUKA PHAMACEUTICAL CO., LTD. (JP) 2008-05-22 US disclosed
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO 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-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis NR2C2, NR0B2, NR4A2 GPR183 1367/4885DGAT1 2335/4885MIF 3726/4885

“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.