SCHEMBL22069029

SCHEMBL22069029

CC(C)(C)OC(=O)N1CCc2n[nH]c(C(=O)NC/N=C(\CBr)C(F)(F)F)c2C1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MTOR P42345 3/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
C5AR1 P21730 2/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
F12 P00748 1/20 0.32
GRAMD1A Q96CP6 1/20 0.32
NAMPT P43490 1/20 0.32
PARP1 P09874 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PARP2 Q9UGN5 1/20 0.32
ADORA1 P30542 2/20 0.32
ESR2 Q92731 1/20 0.31
NR1H2 P55055 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
SCHEMBL22069030 0.82 PDE10A (0.35) MAPTMTORC5AR1DDB1CRBN
SCHEMBL28700403 0.82 L3MBTL1 (0.41) MAPTL3MBTL1MTORHDAC1HDAC6
SCHEMBL22069334 0.80 L3MBTL1 (0.34) MAPTL3MBTL1MTORHDAC1HDAC6
SCHEMBL22068975 0.77 MAPT (0.37) MAPTL3MBTL1MTORHDAC1HDAC6
SCHEMBL22068991 0.75 GCK (0.37) MAPTL3MBTL1MTORHDAC1HDAC6
SCHEMBL22715571 0.75 ADORA1 (0.46) MAPTMTORC5AR1DDB1CRBN
SCHEMBL22738284 0.73 MAPT (0.41) MAPTMTORC5AR1DDB1CRBN
SCHEMBL22029691 0.72 ADORA1 (0.51) MAPTMTORC5AR1DDB1CRBN
SCHEMBL22727594 0.72 MAPT (0.40) MAPTMTORHDAC1HDAC6C5AR1
SCHEMBL22102760 0.71 PARP1 (0.40) MAPTMTORC5AR1DDB1CRBN

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
US-20210252014-A1 OXADIAZEPINONE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS INC (US) 2021-08-19 US disclosed
US-10987359-B2 Oxadiazepinone derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2021-04-27 US disclosed
US-20200197408-A1 OXADIAZEPINONE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2020-06-25 US disclosed
EP-3478692-B1 OXADIAZEPINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS INC (US) 2020-06-17 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 (3 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-10987359-B2 Oxadiazepinone derivatives and methods of treating hepatitis B infections HCCS, SLC10A1, PYGL MAPT 4786/4885L3MBTL1 4809/4885MTOR 2080/4885
US-20210252014-A1 OXADIAZEPINONE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS MAPT 4805/4885L3MBTL1 4655/4885MTOR 2291/4885
US-20200197408-A1 OXADIAZEPINONE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HCCS, SLC10A1, PYGL MAPT 4786/4885L3MBTL1 4809/4885MTOR 2080/4885

“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.