SCHEMBL5541304

SCHEMBL5541304

O=COCCCCCc1ccc(-c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 2/20 0.49
HDAC1 Q13547 1/20 0.49
MGLL Q99685 2/20 0.47
FFAR1 O14842 2/20 0.43
FDFT1 P37268 2/20 0.43
S1PR1 P21453 2/20 0.42
SIGMAR1 Q99720 1/20 0.42
S1PR3 Q99500 1/20 0.42
S1PR5 Q9H228 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
SCHEMBL5541722 1.00 HDAC2 (0.49) HDAC2HDAC1MGLLFFAR1FDFT1
SCHEMBL5542123 0.98 HDAC2 (0.47) HDAC2HDAC1MGLLFFAR1FDFT1
SCHEMBL5542777 0.93 FFAR1 (0.46) HDAC2HDAC1MGLLFFAR1FDFT1
SCHEMBL96962 0.90 SIGMAR1 (0.52) FFAR1S1PR1SIGMAR1S1PR3S1PR5
SCHEMBL97332 0.90 SIGMAR1 (0.52) FFAR1S1PR1SIGMAR1S1PR3S1PR5
SCHEMBL2517 0.88 SIGMAR1 (0.48) FFAR1S1PR1SIGMAR1
SCHEMBL5534913 0.86 FFAR1 (0.48) HDAC2FFAR1FDFT1
SCHEMBL5537092 0.86 AGXT (0.42) MGLLFFAR1SIGMAR1
SCHEMBL5536741 0.86 AGXT (0.42) MGLLFFAR1SIGMAR1
SCHEMBL5545719 0.85 TDP1 (0.49) FFAR1S1PR1SIGMAR1S1PR3S1PR5

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 HDAC2 502/4885HDAC1 322/4885MGLL 4717/4885

“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.