SCHEMBL20714741

SCHEMBL20714741

COc1ccc(O)cc1-c1ccc(C2=NNC(=O)CC2)cc1F

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 17/20 0.61
PDE3A Q14432 17/20 0.61
PDE4B Q07343 5/20 0.61
PDE4A P27815 3/20 0.61
PDE4C Q08493 3/20 0.61
PDE4D Q08499 3/20 0.61
TDP2 O95551 1/20 0.40

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
SCHEMBL20703085 0.88 PDE3A (0.62) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL20703144 0.85 PDE3B (0.69) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL20714742 0.85 PDE3B (0.51) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL2846170 0.84 PDE3B (0.77) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL20714430 0.82 PDE3B (0.65) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL20703223 0.80 PDE3B (0.58) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL20703149 0.79 PDE3B (0.59) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL20714506 0.78 PDE3B (0.68) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL20702770 0.78 PDE3B (0.58) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL20702805 0.77 PDE3B (0.64) PDE3BPDE3APDE4BPDE4APDE4C

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-2019025554-A1 6-PHENYL-4,5-DIHYDROPYRIDAZIN-3(2H)-ONE DERIVATIVES AS PDE3A AND PDE3B INHIBITORS FOR TREATING CANCER BAYER AKTIENGESELLSCHAFT (DE) 2019-02-07 WO disclosed