SCHEMBL5537423

SCHEMBL5537423

O=C(Cl)N1CCN(C(=O)OCc2ccc(OC(F)(F)F)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 8/20 0.53
ATXN2 Q99700 5/20 0.53
DGAT2 Q96PD7 1/20 0.49
HRH2 P25021 1/20 0.48
HRH1 P35367 1/20 0.48
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CHRM4 P08173 1/20 0.47
HRH3 Q9Y5N1 2/20 0.46
LSS P48449 1/20 0.46
CA2 P00918 2/20 0.46
P2RY1 P47900 1/20 0.45
PANK3 Q9H999 1/20 0.45
P2RX7 Q99572 1/20 0.44

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
SCHEMBL542704 0.86 EPHX2 (0.56) ENPP2ATXN2DGAT2HRH2HRH1
SCHEMBL4678739 0.85 P2RX7 (0.55) ENPP2ATXN2DGAT2HRH2HRH1
SCHEMBL543243 0.84 ENPP2 (0.53) ENPP2ATXN2DGAT2HRH2HRH1
SCHEMBL5545594 0.84 HRH2 (0.56) ENPP2ATXN2DGAT2HRH2HRH1
Hydrochloric Acid SCHEMBL4681689 0.83 ENPP2 (0.53) ENPP2ATXN2DGAT2HRH2HRH1
SCHEMBL5542731 0.82 ALDH1A1 (0.65) ALDH1A1LMNACHRM4HRH3LSS
SCHEMBL5541797 0.81 HRH2 (0.59) ENPP2ATXN2DGAT2HRH2HRH1
SCHEMBL2093190 0.80 ENPP2 (0.50) ENPP2ATXN2DGAT2HRH2HRH1
SCHEMBL5537935 0.80 HRH2 (0.58) ENPP2ATXN2DGAT2HRH2HRH1
SCHEMBL27610610 0.80 HRH3 (0.51) ENPP2ATXN2DGAT2HRH2HRH1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
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
CN-101255170-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-09-03 CN disclosed
CN-101172981-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-05-07 CN disclosed
CN-100366624-C 2, 3-dihydro-6-nitroimidazo [2,1-b ] * azole compounds OTSUKA PHARMA CO LTD (JP) 2008-02-06 CN 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
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN 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 ENPP2 2915/4885ATXN2 3603/4885DGAT2 1966/4885

“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.