SCHEMBL22068993

SCHEMBL22068993

CC(CO)ON(C)C(=O)c1[nH]nc2c1CN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.35
GCK P35557 2/20 0.34
MAPT P10636 2/20 0.34
GRAMD1A Q96CP6 1/20 0.34
F12 P00748 1/20 0.34
C5AR1 P21730 5/20 0.33
ADORA1 P30542 2/20 0.33
ESR2 Q92731 1/20 0.33
PARP1 P09874 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
PARP2 Q9UGN5 1/20 0.33
NR1H2 P55055 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
MTOR P42345 1/20 0.32

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
SCHEMBL22069271 0.86 ADORA1 (0.39) PDE10AMAPTGRAMD1AF12C5AR1
SCHEMBL22068976 0.84 PDE10A (0.36) PDE10AMAPTGRAMD1AF12C5AR1
SCHEMBL22102760 0.82 PARP1 (0.40) PDE10AMAPTGRAMD1AF12C5AR1
SCHEMBL22068991 0.80 GCK (0.37) GCKMAPTGRAMD1AF12C5AR1
SCHEMBL22069457 0.80 ADORA1 (0.38) PDE10AMAPTF12C5AR1ADORA1
SCHEMBL22624658 0.80 DDB1 (0.36) PDE10AMAPTF12C5AR1ADORA1
SCHEMBL22029563 0.79 PDE10A (0.39) PDE10AMAPTF12C5AR1ADORA1
SCHEMBL22715571 0.78 ADORA1 (0.46) PDE10AMAPTGRAMD1AF12C5AR1
SCHEMBL28700403 0.77 L3MBTL1 (0.41) MAPTGRAMD1AF12C5AR1ADORA1
SCHEMBL22069377 0.77 F12 (0.36) PDE10AMAPTF12C5AR1ADORA1

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
CN-109843892-B Oxadiazepinone derivatives and their use in the treatment of hepatitis B infections 诺维拉治疗公司 2022-01-25 CN disclosed
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 PDE10A 802/4885GCK 1608/4885MAPT 4786/4885
US-20210252014-A1 OXADIAZEPINONE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS PDE10A 1147/4885GCK 1405/4885MAPT 4805/4885
US-20200197408-A1 OXADIAZEPINONE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HCCS, SLC10A1, PYGL PDE10A 802/4885GCK 1608/4885MAPT 4786/4885

“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.