SCHEMBL5548099

SCHEMBL5548099

CCCCC1Cc2cc([O])ccc2O1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 7/20 0.40
HRH3 Q9Y5N1 5/20 0.38
HRH4 Q9H3N8 1/20 0.38
GRM2 Q14416 2/20 0.37
TDP1 Q9NUW8 1/20 0.34
SGPL1 O95470 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
CYP1A2 P05177 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 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
SCHEMBL5536723 0.95 SIRT2 (0.45) SIRT2HRH3HRH4GRM2SGPL1
SCHEMBL5537744 0.94 SIRT2 (0.44) SIRT2GRM2SGPL1CYP1A2S1PR1
SCHEMBL5541999 0.91 HRH3 (0.40) SIRT2HRH3HRH4TDP1FFAR1
SCHEMBL5546421 0.88 SIRT2 (0.38) SIRT2GRM2CYP1A2
SCHEMBL5536590 0.84 HRH3 (0.41) HRH3HRH4TDP1FFAR1FFAR4
SCHEMBL5538983 0.84 SIRT2 (0.43) SIRT2GRM2CYP1A2
SCHEMBL5542144 0.82 SIRT2 (0.42) SIRT2GRM2CYP1A2
SCHEMBL5548100 0.82 SHBG (0.43) HRH3HRH4GRM2CYP1A2
SCHEMBL20958651 0.82 AKR1B1 (0.41) SIRT2HRH3HRH4GRM2FFAR1
SCHEMBL28017915 0.82 SIRT2 (0.42) SIRT2HRH3HRH4

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 SIRT2 309/4885HRH3 420/4885HRH4 426/4885

“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.