SCHEMBL11206290

SCHEMBL11206290

CCC1CC(=O)NN=C1c1ccc(-n2ccnc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 14/20 1.00
PDE3A Q14432 14/20 1.00
PDE2A O00408 2/20 1.00
PDE4A P27815 2/20 0.73
PDE4B Q07343 2/20 0.73
PDE4C Q08493 2/20 0.73
PDE4D Q08499 2/20 0.73
LMNA P02545 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
TSHR P16473 1/20 0.55
MAPK1 P28482 1/20 0.55
CYP2C19 P33261 1/20 0.55
GPR119 Q8TDV5 4/20 0.46
PDE1A P54750 1/20 0.45
PDE1B Q01064 1/20 0.45
PDE1C Q14123 1/20 0.45
FBP1 P09467 1/20 0.45

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
Ci-930 SCHEMBL6052113 0.84 PDE3B (1.00) PDE3BPDE3APDE2APDE4APDE4B
Ci-930 SCHEMBL10657390 0.83 PDE3B (0.98) PDE3BPDE3APDE2APDE4APDE4B
SCHEMBL10730608 0.80 PDE3B (0.67) PDE3BPDE3APDE2APDE4APDE4B
SCHEMBL11204857 0.79 PDE3B (0.73) PDE3BPDE3APDE2APDE4APDE4B
SCHEMBL10724940 0.79 PDE3B (0.65) PDE3BPDE3APDE2APDE4APDE4B
SCHEMBL11202941 0.78 PDE3B (0.68) PDE3BPDE3APDE2APDE4APDE4B
Ci-930 SCHEMBL10994723 0.77 PDE3B (0.83) PDE3BPDE3APDE2APDE4APDE4B
Ci-930 SCHEMBL10994729 0.77 PDE3B (0.83) PDE3BPDE3APDE2APDE4APDE4B
SCHEMBL9686758 0.77 PDE2A (0.62) PDE3BPDE3APDE2AGPR119
SCHEMBL11098328 0.76 PDE3B (0.61) PDE3BPDE3APDE2APDE4APDE4B

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