SCHEMBL7293060

SCHEMBL7293060

O=Cc1ccc(-n2cnc3c2CCCC3)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 5/20 0.54
▸ PDE3A Q14432 5/20 0.54
▸ PDE2A O00408 2/20 0.54
▸ PDE1A P54750 1/20 0.49
▸ PDE1B Q01064 1/20 0.49
▸ PDE1C Q14123 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.44
▸ TRIM24 O15164 1/20 0.43
▸ TRIM33 Q9UPN9 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ CYP11B2 P19099 4/20 0.40
▸ KCNJ1 P48048 1/20 0.37

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
SCHEMBL11006142 0.84 PDE3B (0.52) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10548815 0.82 KCNJ1 (0.44) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL17185938 0.80 PDE3B (0.53) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL7425735 0.80 PDE3B (0.52) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL7404429 0.78 PDE3B (0.47) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL7404431 0.78 PDE3B (0.47) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL7381531 0.77 CYP11B2 (0.52) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL7282912 0.76 PDE3B (0.66) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL7303663 0.76 PDE3B (0.48) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10833710 0.76 PDE3B (0.66) PDE3BPDE3APDE2APDE1APDE1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0102227-B1 2(1H)-PYRIDINONES, USEFUL AS CARDIOTONIC AGENTS, AND THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1989-05-03 — — EP disclosed
US-4717730-A HYPOTENSIVE AND CARDIOTONIC AGENTS WARNER-LAMBERT COMPANY (US) 1988-01-05 — — US disclosed
US-4607037-A Cardiotonic 2(1H)-pyridinones WARNER-LAMBERT COMPANY (US) 1986-08-19 — — US disclosed
US-4599332-A CARDIOTONIC, HYPOTENSIVE WARNER-LAMBERT COMPANY (US) 1986-07-08 — — US disclosed
EP-0145450-A2 6- [2-[4-(1H-imidazol-1-yl)phenyl]-alkylene and alkylenyl]-3(2H)-pyridazinones, the 4,5-dihydro- pyridazinone derivatives thereof, and a process for the preparation thereof WARNER-LAMBERT COMPANY (US) 1985-06-19 — — EP disclosed
US-4503061-A Substituted phenyl-pyridinones as cardiotonic agents WARNER-LAMBERT COMPANY (US) 1985-03-05 — — US disclosed
EP-0102227-A2 2(1H)-pyridinones, useful as cardiotonic agents, and their production WARNER-LAMBERT COMPANY (US) 1984-03-07 — — EP disclosed
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