SCHEMBL5541977

SCHEMBL5541977

CCCCCSc1ccc([O])cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.50
THRA P10827 1/20 0.50
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
PLK1 P53350 4/20 0.43
CA2 P00918 2/20 0.43
SLC2A1 P11166 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA7 P43166 1/20 0.43
CA13 Q8N1Q1 1/20 0.43
PTGS2 P35354 3/20 0.42
HPGD P15428 1/20 0.41
SOAT1 P35610 3/20 0.40
GPR84 Q9NQS5 1/20 0.40
XDH P47989 1/20 0.40

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
SCHEMBL5536227 0.98 THRB (0.53) THRBTHRAMAOAMAOBPLK1
SCHEMBL4384628 0.98 THRB (0.53) THRBTHRAMAOAMAOBPLK1
SCHEMBL5541499 0.94 MAOA (0.53) THRBTHRAMAOAMAOBPLK1
SCHEMBL11567371 0.87 THRB (0.56) THRBTHRAMAOAMAOBPLK1
SCHEMBL21575599 0.87 THRB (0.56) THRBTHRAMAOAMAOBPLK1
SCHEMBL21575598 0.87 THRB (0.56) THRBTHRAMAOAMAOBPLK1
SCHEMBL11569857 0.87 THRB (0.56) THRBTHRAMAOAMAOBPLK1
SCHEMBL5539030 0.85 CA12 (0.57) THRBTHRAMAOAMAOBCA2
SCHEMBL10527738 0.83 SLC2A1 (0.60) THRBTHRAMAOAMAOBPLK1
SCHEMBL5887468 0.82 MAOA (0.62) THRBTHRAMAOAMAOBPLK1

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 THRB 488/4885THRA 434/4885MAOA 2885/4885

“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.