SCHEMBL20159196

SCHEMBL20159196

COCCCN1N=C(c2ccc(N)cc2)C(C)CC1=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 13/20 0.43
PDE3A Q14432 12/20 0.43
HRH3 Q9Y5N1 3/20 0.38
PDE4A P27815 2/20 0.38
PDE4C Q08493 2/20 0.38
PDE4D Q08499 2/20 0.38
REN P00797 4/20 0.37
PDE3B Q13370 1/20 0.36

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
SCHEMBL20159457 0.93 PDE4B (0.39) PDE4BPDE3AHRH3PDE4APDE4C
SCHEMBL20159121 0.93 PDE4B (0.39) PDE4BPDE3AHRH3PDE4APDE4C
SCHEMBL20159102 0.93 PDE4B (0.39) PDE4BPDE3AHRH3PDE4APDE4C
SCHEMBL20138889 0.89 PDE4B (0.41) PDE4BPDE3AHRH3PDE4APDE4C
SCHEMBL20159108 0.83 PDE4B (0.38) PDE4BPDE3APDE4APDE4CPDE4D
SCHEMBL20142921 0.81 PDE4B (0.40) PDE4BPDE3AHRH3PDE4APDE4C
SCHEMBL20159428 0.81 PDE4B (0.40) PDE4BPDE3APDE4APDE4CPDE4D
SCHEMBL22923656 0.80 TNF (0.43) PDE4BPDE3AHRH3PDE4APDE4C
SCHEMBL28975138 0.80 PDE4B (0.46) PDE4BPDE3APDE4APDE4CPDE4D
SCHEMBL20143661 0.80 CD274 (0.45) PDE3AHRH3PDE4DPDE3B

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-2018086703-A1 DIHYDROPYRIDAZINONES SUBSTITUTED WITH PHENYLUREAS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-05-17 WO disclosed