SCHEMBL29842844

SCHEMBL29842844

C[C@H]1OC(=O)NN=C1c1ccc(N2CCOCC2)c(C(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 20/20 1.00
▸ PDE3A Q14432 19/20 1.00

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
SCHEMBL29842732 1.00 PDE3B (1.00) PDE3BPDE3A
SCHEMBL20702876 1.00 PDE3B (1.00) PDE3BPDE3A
SCHEMBL20702583 1.00 PDE3B (1.00) PDE3BPDE3A
SCHEMBL20705328 0.89 PDE3B (1.00) PDE3BPDE3A
SCHEMBL29842868 0.89 PDE3B (1.00) PDE3BPDE3A
SCHEMBL20702807 0.87 PDE3B (1.00) PDE3BPDE3A
SCHEMBL30692586 0.87 PDE3B (1.00) PDE3BPDE3A
SCHEMBL20702904 0.87 PDE3B (1.00) PDE3BPDE3A
SCHEMBL22697068 0.86 PDE3B (1.00) PDE3BPDE3A
SCHEMBL26364082 0.86 PDE3B (1.00) PDE3BPDE3A

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-4301371-A1 SUBSTITUTED 3,6-DIHYDRO-2H-1,3,4-OXADIAZIN-2-ONES FOR THE TREATMENT OF SARCOMA Bayer Aktiengesellschaft (DE) 2024-01-10 — — EP claimed
CN-117279644-A Substituted 3, 6-dihydro-2H-1, 3, 4-oxadiazin-2-ones for the treatment of sarcomas 拜耳股份有限公司 2023-12-22 — — CN claimed
WO-2022184748-A1 SUBSTITUTED 3,6-DIHYDRO-2H-1,3,4-OXADIAZIN-2-ONES FOR THE TREATMENT OF SARCOMA BAYER AKTIENGESELLSCHAFT (DE) 2022-09-09 — — WO claimed
CN-117279644-A Substituted 3, 6-dihydro-2H-1, 3, 4-oxadiazin-2-ones for the treatment of sarcomas 拜耳股份有限公司 2023-12-22 — — CN disclosed
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