SCHEMBL5544875

SCHEMBL5544875

Fc1cccc(CC[C]=S)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.57
MIF P14174 1/20 0.55
DAO P14920 3/20 0.49
SLC6A3 Q01959 2/20 0.47
IDO1 P14902 2/20 0.46
AGXT P21549 2/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
DRD2 P14416 1/20 0.45
SLC6A4 P31645 1/20 0.45
DBH P09172 1/20 0.42
GPR84 Q9NQS5 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
SCHEMBL3371633 0.80 TAAR1 (0.74) TAAR1MIFDAOSLC6A3IDO1
SCHEMBL5543604 0.80 TAAR1 (0.57) TAAR1MIFDAOSLC6A3IDO1
SCHEMBL2023893 0.80 MEN1 (0.73) TAAR1MIFDAOSLC6A3IDO1
SCHEMBL13099035 0.80 TAAR1 (0.57) TAAR1MIFDAOSLC6A3IDO1
SCHEMBL3634117 0.79 MIF (0.58) TAAR1MIFSLC6A3IDO1AGXT
SCHEMBL5546168 0.79 DAO (0.40) MIFDAOIDO1DBH
SCHEMBL5543807 0.76 TAAR1 (0.57) TAAR1DAOIDO1AGXTMEN1
SCHEMBL5542699 0.74 TAAR1 (0.50) TAAR1MIFDAOIDO1
SCHEMBL144864 0.74 TAAR1 (0.72) TAAR1MIFDAOSLC6A3IDO1
SCHEMBL8591746 0.74 TAAR1 (0.65) TAAR1DAOSLC6A3IDO1AGXT

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 TAAR1 364/4885MIF 1824/4885DAO 1115/4885

“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.