SCHEMBL29628632

SCHEMBL29628632

CC1CC(=O)NN=C1c1ccc(O)c(F)c1F

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PBRM1 Q86U86 1/20 0.47
▸ PDE3A Q14432 18/20 0.46
▸ PDE3B Q13370 6/20 0.46
▸ PDE4B Q07343 14/20 0.45
▸ PDE4A P27815 2/20 0.44
▸ PDE4C Q08493 2/20 0.44
▸ PDE4D Q08499 2/20 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
SCHEMBL2845195 1.00 PBRM1 (0.47) PBRM1PDE3APDE3BPDE4BPDE4A
SCHEMBL29628642 0.89 PBRM1 (0.45) PBRM1PDE3APDE3BPDE4BPDE4A
SCHEMBL20607178 0.89 PBRM1 (0.45) PBRM1PDE3APDE3BPDE4BPDE4A
SCHEMBL20607501 0.89 PBRM1 (0.45) PBRM1PDE3APDE3BPDE4BPDE4A
SCHEMBL20607245 0.88 PDE3A (0.49) PBRM1PDE3APDE3BPDE4BPDE4A
SCHEMBL29628609 0.86 PDE3A (0.50) PBRM1PDE3APDE3BPDE4BPDE4A
SCHEMBL20607340 0.86 PDE3A (0.50) PBRM1PDE3APDE3BPDE4BPDE4A
SCHEMBL20607041 0.86 PDE3A (0.47) PBRM1PDE3APDE3BPDE4BPDE4A
SCHEMBL29628659 0.85 PDE3A (0.42) PBRM1PDE3APDE3BPDE4BPDE4A
SCHEMBL20607255 0.85 PDE3A (0.42) PBRM1PDE3APDE3BPDE4BPDE4A

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
CN-108779076-B 5-methyl-6-phenyl-4, 5-dihydro-2H-pyridazin-3-one derivatives 大塚制药株式会社 2022-05-03 — — CN disclosed
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