SCHEMBL5538733

SCHEMBL5538733

CC1(Cn2c(=O)oc3ccc(Cl)cc32)CO1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 8/20 0.58
NOS3 P29474 6/20 0.56
NOS1 P29475 6/20 0.56
NOS2 P35228 6/20 0.56
TMEM97 Q5BJF2 3/20 0.54
KMO O15229 1/20 0.53
PTGS2 P35354 1/20 0.48

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
SCHEMBL5538956 0.84 SIGMAR1 (0.46) IDO1NOS3NOS1NOS2TMEM97
SCHEMBL5544872 0.84 CD74 (0.54) IDO1NOS3NOS1NOS2
SCHEMBL5540024 0.81 TSPO (0.46)
SCHEMBL5541140 0.80 TSHR (0.58) IDO1
SCHEMBL6425871 0.78 IDO1 (0.69) IDO1NOS3NOS1NOS2TMEM97
SCHEMBL5534462 0.76 PARG (0.45)
SCHEMBL5543507 0.76 LMNA (0.44) NOS3NOS1NOS2TMEM97
SCHEMBL23964619 0.75 IDO1 (0.69) IDO1NOS3NOS1NOS2TMEM97
SCHEMBL5539513 0.75 CYP1A2 (0.45)
SCHEMBL19398562 0.74 IDO1 (0.67) IDO1NOS3NOS1NOS2TMEM97

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 IDO1 3181/4885NOS3 214/4885NOS1 553/4885

“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.