SCHEMBL5543571

SCHEMBL5543571

C=CCCc1ccccc1[O]

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.33
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
GPR52 Q9Y2T5 1/20 0.31
CYP3A4 P08684 1/20 0.31
ACHE P22303 1/20 0.30

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
SCHEMBL5538657 0.88 TLR8 (0.45) TLR8MAPTKDM4EUSP2ALDH1A1
SCHEMBL5539439 0.86 TDP1 (0.43) TLR8MAPTKDM4EUSP2ALDH1A1
SCHEMBL8072326 0.78 GABRA1 (0.38) TLR8MAPTKDM4EALDH1A1GABRA1
SCHEMBL8698489 0.78 TAAR1 (0.35) MAPTALDH1A1GABRA1GABRB2
SCHEMBL384205 0.77 GABRA1 (0.47) MAPTKDM4EALDH1A1GABRA1GABRB2
SCHEMBL11186151 0.76 TLR8 (0.34) TLR8MAPTUSP2ALDH1A1HPGD
SCHEMBL17006106 0.75 LMNA (0.46) TLR8MAPTALDH1A1HPGDTDP1
SCHEMBL3644364 0.74 PNMT (0.41) TLR8KDM4EUSP2ALDH1A1HPGD
SCHEMBL7563209 0.74 TAAR1 (0.56) ALDH1A1HPGD
SCHEMBL248640 0.74 TAAR1 (0.54) TLR8USP2ALDH1A1HPGDTDP1

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 6 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
US-4720533-A Polyorganophosphazene curable in atmosphere ETHYL CORPORATION (US) 1988-01-19 US 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 TLR8 1198/4885MAPT 4117/4885KDM4E 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.