SCHEMBL5541913

SCHEMBL5541913

COc1ccc(C2CC[N]CC2)cc1OC

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.59
PDE4A P27815 7/20 0.50
PDE4B Q07343 6/20 0.50
PDE4C Q08493 5/20 0.50
PDE4D Q08499 5/20 0.50
QDPR P09417 1/20 0.46
PTAFR P25105 1/20 0.46
HIF1A Q16665 1/20 0.46

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
SCHEMBL1494013 0.87 NR3C1 (0.64) NR3C1PDE4APDE4BPDE4CPDE4D
SCHEMBL5584588 0.86 NR3C1 (0.43) NR3C1PDE4APDE4BPDE4CPDE4D
Ammonia Solution, Strong SCHEMBL7288975 0.85 NR3C1 (0.62) NR3C1PDE4APDE4BPDE4CPDE4D
SCHEMBL5584959 0.85 QDPR (0.43) NR3C1PDE4APDE4BPDE4CPDE4D
SCHEMBL5584589 0.85 NR3C1 (0.42) NR3C1PDE4APDE4BPDE4CPDE4D
SCHEMBL9188312 0.83 NR3C1 (0.60) NR3C1PDE4APDE4BPDE4CPDE4D
SCHEMBL9325871 0.81 PDE4A (0.59) NR3C1PDE4APDE4BPDE4CPDE4D
SCHEMBL5584986 0.80 PTAFR (0.53) PTAFR
SCHEMBL2473309 0.79 PDE4B (0.64) NR3C1PDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL9772895 0.77 PDE4B (0.62) NR3C1PDE4APDE4BPDE4CPDE4D

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 11 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-7196199-B2 Antiserotonine agents; antidepressants MITSUBISHI PHARMA CORPORATION (JP) 2007-03-27 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-1188747-B1 PHENOXYPROPYLAMINE COMPOUNDS MITSUBISHI PHARMA CORP (JP) 2005-09-07 EP disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed
US-20040138227-A1 Phenoxypropylamine compounds NISHIYAMA AKIRA 2004-07-15 US disclosed
US-6720320-B2 ANTISEROTONINE AGENTS MITSUBISHI PHARMA CORPORATION (JP) 2004-04-13 US disclosed
US-20020111358-A1 Phenoxypropylamine compounds MITSUBISHI PHARMA CORPORATION (JP) 2002-08-15 US disclosed
EP-1188747-A1 PHENOXYPROPYLAMINE COMPOUNDS Mitsubishi Pharma Corporation (JP) 2002-03-20 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 (3 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-20040138227-A1 Phenoxypropylamine compounds HTR1A, HTR1D, HTR5A NR3C1 157/4885PDE4A 921/4885PDE4B 1179/4885
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 NR3C1 26/4885PDE4A 4145/4885PDE4B 3738/4885
US-20020111358-A1 Phenoxypropylamine compounds HTR1A, HTR1D, HTR5A NR3C1 157/4885PDE4A 921/4885PDE4B 1179/4885

“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.