SCHEMBL22314249

SCHEMBL22314249

CCCOc1ccc(C2=NNC(=O)O[C@H]2C)cc1C(F)(F)F

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 20/20 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
SCHEMBL22314164 0.95 PDE3B (0.90) PDE3BPDE3A
SCHEMBL22314300 0.91 PDE3B (1.00) PDE3BPDE3A
SCHEMBL22314315 0.91 PDE3B (0.83) PDE3BPDE3A
SCHEMBL22314313 0.91 PDE3B (1.00) PDE3BPDE3A
SCHEMBL22313744 0.89 PDE3B (0.84) PDE3BPDE3A
SCHEMBL30882638 0.89 PDE3B (0.80) PDE3BPDE3A
SCHEMBL22313726 0.87 PDE3B (0.80) PDE3BPDE3A
SCHEMBL22314247 0.85 PDE3B (1.00) PDE3BPDE3A
SCHEMBL22288437 0.83 PDE3B (0.71) PDE3BPDE3A
SCHEMBL28619784 0.83 PDE3B (0.70) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020157188-A1 DIHYDROOXADIAZINONES FOR THE TREATMENT OF HYPERPROLIFERATIVE DISEASES BAYER AKTIENGESELLSCHAFT (DE) 2020-08-06 — — WO disclosed
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