SCHEMBL5542851

SCHEMBL5542851

[CH2]c1ccccc1Oc1ccc(Cl)c(Cl)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.37
FABP3 P05413 1/20 0.35
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
CYP2A6 P11509 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
AR P10275 1/20 0.32
SLC6A2 P23975 5/20 0.32
SLC6A3 Q01959 5/20 0.32
SLC6A4 P31645 4/20 0.32
AKR1B1 P15121 1/20 0.31
HTR1A P08908 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
CXCL8 P10145 1/20 0.31

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
SCHEMBL11283671 0.81 CYP3A4 (0.43) RHEBFABP3ALDH1A1HPGDCYP2A6
SCHEMBL5541601 0.79 HPGD (0.48) RHEBALDH1A1HPGDSLC6A2SLC6A3
SCHEMBL7634253 0.78 CA1 (0.38) ALDH1A1HPGDMAPK1
SCHEMBL319832 0.77 CYP3A4 (0.45) RHEBFABP3ALDH1A1HPGDSLC6A2
SCHEMBL1340460 0.77 MAPT (0.46) RHEBFABP3ALDH1A1HPGDCYP3A4
SCHEMBL30290439 0.77 L3MBTL1 (0.50) ALDH1A1HPGDARSLC6A2SLC6A3
SCHEMBL10829853 0.76 TTR (0.55) RHEBALDH1A1HPGDMRGPRX4SLC6A2
SCHEMBL304918 0.74 CYP1A2 (0.48) RHEBFABP3ALDH1A1CYP3A4
SCHEMBL5544824 0.72 HTR2A (0.54) ARSLC6A2SLC6A3SLC6A4CYP3A4
SCHEMBL5548072 0.71 MEN1 (0.35) ALDH1A1HPGDSLC6A4CYP3A4MAPK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 RHEB 1317/4885FABP3 349/4885ALDH1A1 355/4885

“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.