SCHEMBL5536723

SCHEMBL5536723

CCCCCC1Cc2cc([O])ccc2O1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 7/20 0.45
CYP1A2 P05177 2/20 0.39
GRM2 Q14416 4/20 0.38
PPARG P37231 1/20 0.38
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
S1PR1 P21453 3/20 0.37
SMPD1 P17405 1/20 0.37
SGPL1 O95470 1/20 0.37
S1PR3 Q99500 1/20 0.37

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
SCHEMBL5537744 0.99 SIRT2 (0.44) SIRT2CYP1A2GRM2PPARGS1PR1
SCHEMBL5548099 0.95 SIRT2 (0.40) SIRT2CYP1A2GRM2HRH4HRH3
SCHEMBL5541999 0.89 HRH3 (0.40) SIRT2HRH4HRH3
SCHEMBL5538983 0.88 SIRT2 (0.43) SIRT2CYP1A2GRM2PPARG
SCHEMBL5542144 0.87 SIRT2 (0.42) SIRT2CYP1A2GRM2PPARGSMPD1
SCHEMBL5546421 0.84 SIRT2 (0.38) SIRT2CYP1A2GRM2
SCHEMBL5536590 0.83 HRH3 (0.41) HRH4HRH3
SCHEMBL7797531 0.82 GRM2 (0.45) SIRT2GRM2HRH4HRH3S1PR1
SCHEMBL5536727 0.82 GRM2 (0.44) SIRT2GRM2HRH4HRH3
SCHEMBL5537748 0.81 GRM2 (0.46) SIRT2GRM2PPARGHRH4HRH3

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 309/4885CYP1A2 659/4885GRM2 248/4885

“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.