SCHEMBL5535686

SCHEMBL5535686

CC(Oc1cc[c]cc1)c1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.40
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
F9 P00740 1/20 0.36
SLC6A4 P31645 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
IDO1 P14902 2/20 0.35
TDO2 P48775 2/20 0.35
ALOX5 P09917 1/20 0.35
KDM5A P29375 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
KDM5B Q9UGL1 1/20 0.33
FFAR1 O14842 1/20 0.33

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
SCHEMBL11419605 0.83 ALOX5 (0.36) ALDH1A1SLC6A4MEN1KMT2ANPSR1
SCHEMBL5535581 0.81 L3MBTL1 (0.42) ALDH1A1SMN1; SMN2SLC6A4NPSR1IDO1
SCHEMBL864142 0.81 FFAR1 (0.49) ALOX5FFAR1
SCHEMBL5542031 0.80 HTR6 (0.42) SLC6A4MEN1KMT2AIDO1TDO2
SCHEMBL5958277 0.77 FFAR1 (0.45) ALOX5FFAR1
SCHEMBL7465279 0.75 SRD5A2 (0.41) PPARAALDH1A1SMN1; SMN2SLC6A4NPSR1
SCHEMBL7503937 0.74 ESR1 (0.41) ALDH1A1SMN1; SMN2SLC6A4IDO1TDO2
SCHEMBL9641120 0.74 KMT2A (0.48) PPARAALDH1A1SMN1; SMN2SLC6A4MEN1
SCHEMBL17514988 0.74 IDO1 (0.32) ALDH1A1SMN1; SMN2IDO1TDO2
SCHEMBL14967363 0.73 PPARA (0.59) PPARAALDH1A1KMT2ANPSR1ALOX5

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 PPARA 429/4885ALDH1A1 355/4885SMN1; SMN2 3985/4885

“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.