SCHEMBL17289802

SCHEMBL17289802

CC(C)(C)OC(=O)N1CCC(Oc2ccc(B(O)O)cc2C#N)CC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.53
TBK1 Q9UHD2 7/20 0.49
PDE4B Q07343 3/20 0.49
PDE4D Q08499 3/20 0.49
PDE4A P27815 2/20 0.49
PDE4C Q08493 2/20 0.49
IKBKE Q14164 1/20 0.48
KDM1A O60341 1/20 0.44

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
SCHEMBL1667168 0.85 GPR119 (0.55) GPR119TBK1PDE4BPDE4DPDE4A
SCHEMBL3085652 0.85 GPR119 (0.55) GPR119TBK1PDE4BPDE4DPDE4A
SCHEMBL14453674 0.85 GPR119 (0.58) GPR119TBK1PDE4BPDE4DPDE4A
SCHEMBL31079453 0.84 PDE4B (0.65) GPR119PDE4BPDE4DPDE4APDE4C
SCHEMBL2557402 0.84 PDE4B (0.65) GPR119PDE4BPDE4DPDE4APDE4C
SCHEMBL20900716 0.83 GPR119 (0.48) GPR119TBK1PDE4BPDE4DPDE4A
SCHEMBL28909021 0.83 GPR119 (0.53) GPR119TBK1PDE4BPDE4DPDE4A
SCHEMBL3069360 0.82 GPR119 (0.59) GPR119TBK1PDE4BPDE4DPDE4A
SCHEMBL14087517 0.81 GPR119 (0.67) GPR119TBK1PDE4BPDE4DPDE4A
SCHEMBL26210195 0.80 GPR119 (0.54) GPR119TBK1PDE4BPDE4DPDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3152210-B1 TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES INC (US) 2023-07-05 EP disclosed
US-10259811-B2 Tank-binding kinase inhibitor compounds GILEAD SCIENCES, INC. (US) 2019-04-16 US disclosed
US-20190016717-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2019-01-17 US disclosed
US-10072001-B2 Tank-binding kinase inhibitor compounds GILEAD SCIENCES, INC. (US) 2018-09-11 US disclosed
EP-3152210-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS Gilead Sciences, Inc. (US) 2017-04-12 EP disclosed
WO-2015187684-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2015-12-10 WO disclosed
US-20150344473-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2015-12-03 US 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 (4 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-20150344473-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS TBKBP1, TNKS1BP1, TNKS GPR119 3446/4885TBK1 4/4885PDE4B 3196/4885
US-10259811-B2 Tank-binding kinase inhibitor compounds TBKBP1, TNKS1BP1, TNKS GPR119 3446/4885TBK1 4/4885PDE4B 3196/4885
US-10072001-B2 Tank-binding kinase inhibitor compounds TBKBP1, TNKS1BP1, TNKS GPR119 3446/4885TBK1 4/4885PDE4B 3196/4885
US-20190016717-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS TBKBP1, TNKS1BP1, TNKS GPR119 3446/4885TBK1 4/4885PDE4B 3196/4885

“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.