SCHEMBL5537491

SCHEMBL5537491

Oc1ccc(N2CCC(Nc3ccccc3OC(F)(F)F)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ME3 Q16798 3/20 0.44
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
EPHX2 P34913 1/20 0.40
CHRM4 P08173 4/20 0.40
TYR P14679 1/20 0.39
SCD O00767 1/20 0.38
SSTR1 P30872 1/20 0.38
SSTR4 P31391 1/20 0.38
CASR P41180 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
S1PR1 P21453 1/20 0.37
ME2 P23368 1/20 0.37
ME1 P48163 1/20 0.37
GBA1 P04062 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
SCHEMBL5539025 0.91 ME3 (0.43) ME3DDB1CRBNGAAKMT2A
SCHEMBL5537487 0.88 DDB1 (0.46) DDB1CRBNGAAEPHX2CHRM4
SCHEMBL5544175 0.84 TYR (0.53) ME3GAAKMT2ATYR
SCHEMBL5544314 0.81 SCD (0.57) ME3GAAKMT2ASCDTDP1
SCHEMBL5535585 0.79 GAA (0.53) ME3GAAKMT2ATDP1ME2
SCHEMBL5541087 0.79 SCD (0.46) ME3GAAKMT2ASCDTDP1
SCHEMBL5539021 0.79 SCD (0.37) ME3DDB1CRBNGAAEPHX2
SCHEMBL5542573 0.79 NOTUM (0.46) ME3GAACHRM4CASR
SCHEMBL5544285 0.78 CHRM4 (0.49) EPHX2CHRM4CASR
SCHEMBL5536343 0.77 ME3 (0.50) ME3GAAKMT2ATDP1ME2

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 ME3 146/4885DDB1 524/4885CRBN 2133/4885

“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.