SCHEMBL7410102

SCHEMBL7410102

Cc1[nH]c(=O)c(C(N)=O)cc1-c1ccc(-n2ccnc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 6/20 0.64
PDE3A Q14432 6/20 0.64
PDE2A O00408 3/20 0.64
PDE1A P54750 2/20 0.64
PDE1B Q01064 2/20 0.64
PDE1C Q14123 2/20 0.64
ADH5 P11766 9/20 0.51
PDE4A P27815 2/20 0.48
PDE4B Q07343 2/20 0.48
PDE4C Q08493 2/20 0.48
PDE4D Q08499 2/20 0.48
CCNC P24863 1/20 0.44
CDK8 P49336 1/20 0.44
CYP3A4 P08684 1/20 0.44
BAZ2B Q9UIF8 1/20 0.44
AURKB Q96GD4 1/20 0.42
INCENP Q9NQS7 1/20 0.42

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
SCHEMBL7409627 0.83 PDE3B (0.69) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10762139 0.83 PDE3B (0.72) PDE3BPDE3APDE2APDE1APDE1B
Hydrochloric Acid SCHEMBL10761419 0.82 PDE3B (0.71) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10762619 0.81 PDE3B (0.43) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL7411008 0.81 PDE3B (0.69) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10704473 0.80 CCNC (0.67) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10763661 0.79 PDE3B (0.41) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL7411067 0.78 PDE3A (1.00) PDE3BPDE3APDE2APDE1APDE1B
Hydrochloric Acid SCHEMBL7406382 0.77 PDE3A (0.98) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL3204344 0.77 ADH5 (0.52) PDE3BPDE3APDE2AADH5PDE4A

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 4 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-4607037-A Cardiotonic 2(1H)-pyridinones WARNER-LAMBERT COMPANY (US) 1986-08-19 US 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