SCHEMBL11207365

SCHEMBL11207365

CCc1nccn1-c1ccc(C2=NNC(=O)CC2C)cc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 14/20 0.60
▸ PDE3A Q14432 14/20 0.60
▸ PDE4A P27815 4/20 0.60
▸ PDE4B Q07343 4/20 0.60
▸ PDE4C Q08493 4/20 0.60
▸ PDE4D Q08499 4/20 0.60
▸ PDE2A O00408 2/20 0.57
▸ PDE1A P54750 1/20 0.57
▸ PDE1B Q01064 1/20 0.57
▸ PDE1C Q14123 1/20 0.57
▸ HRH3 Q9Y5N1 3/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ GFER P55789 1/20 0.48

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
SCHEMBL10620570 0.84 PDE3B (0.63) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10625021 0.82 PDE3B (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10729397 0.81 PBRM1 (0.46) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10371893 0.78 PDE3B (0.53) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10353457 0.78 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
Fumaric Acid SCHEMBL11000237 0.77 PDE3B (0.54) PDE3BPDE3APDE4APDE4BPDE4C
Fumaric Acid SCHEMBL11000313 0.77 PDE3B (0.54) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL16157200 0.76 PDE3B (0.73) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL6212361 0.75 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL6212364 0.75 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0090978-A2 Imidazolylphenyl-tetrahydropyridazines, process for their preparation and pharmaceutical compositions containing them A. Nattermann & Cie. GmbH (DE) 1983-10-12 — — EP claimed
EP-0090978-A2 Imidazolylphenyl-tetrahydropyridazines, process for their preparation and pharmaceutical compositions containing them A. Nattermann & Cie. GmbH (DE) 1983-10-12 — — EP disclosed
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