SCHEMBL5539639

SCHEMBL5539639

[O]C1Cc2ccccc2C1=O

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.63
METAP1 P53582 4/20 0.52
CYP19A1 P11511 2/20 0.47
TSHR P16473 1/20 0.47
CES1 P23141 1/20 0.44
MAOA P21397 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
S100A4 P26447 1/20 0.42

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
SCHEMBL14157895 0.81 ACHE (0.63) ACHEMETAP1CYP19A1TSHRCES1
SCHEMBL1332811 0.80 CYP19A1 (0.53) ACHECYP19A1TSHRCES1MAOA
SCHEMBL4459322 0.79 S100A4 (0.61) ACHECYP19A1SMN1; SMN2KDM4EMEN1
SCHEMBL11818087 0.79 ACHE (0.61) ACHEMETAP1CYP19A1TSHRCES1
SCHEMBL9752693 0.77 ACHE (1.00) ACHEMETAP1CYP19A1TSHR
SCHEMBL4938272 0.77 ACHE (1.00) ACHEMETAP1CYP19A1TSHR
SCHEMBL13961310 0.77 ACHE (0.59) ACHEMETAP1CYP19A1TSHRCES1
SCHEMBL296403 0.77 ACHE (0.59) ACHEMETAP1CYP19A1TSHRCES1
SCHEMBL3063845 0.77 ACHE (0.59) ACHEMETAP1CYP19A1TSHRS100A4
SCHEMBL1151054 0.77 S100A4 (0.64) ACHEMETAP1CYP19A1TSHRCES1

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 ACHE 4670/4885METAP1 4619/4885CYP19A1 3120/4885

“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.