SCHEMBL5541733

SCHEMBL5541733

O=[C]CCN1CCN(C(=O)Nc2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 15/20 0.65
NPSR1 Q6W5P4 1/20 0.65
KDM4E B2RXH2 2/20 0.60
MAPT P10636 2/20 0.60
CA12 O43570 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54

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
SCHEMBL5542340 0.86 FAAH (0.59) FAAHKDM4EMAPTCA12CA2
SCHEMBL5536453 0.86 KMT2A (0.58) FAAHNPSR1MAPTCA12CA2
SCHEMBL5546588 0.86 NPC1 (0.58) FAAHKDM4EMAPTCA12CA2
SCHEMBL5544861 0.85 FAAH (0.67) FAAHNPSR1KDM4EMAPTCA12
SCHEMBL5536902 0.83 ALDH1A1 (0.70) NPSR1KDM4E
SCHEMBL5546036 0.83 MAPT (0.70) FAAHMAPT
SCHEMBL5544609 0.83 FAAH (0.60) FAAHNPSR1MAPT
SCHEMBL11202058 0.82 FAAH (0.71) FAAHNPSR1KDM4EMAPTCA12
SCHEMBL3608586 0.82 FAAH (0.86) FAAHNPSR1KDM4EMAPTCA12
SCHEMBL2897923 0.81 KDM4E (0.77) FAAHNPSR1KDM4EMAPTCA12

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 FAAH 4363/4885NPSR1 747/4885KDM4E 4854/4885

“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.