SCHEMBL7346242

SCHEMBL7346242

CC1Oc2cc(C3=NNC(=O)CC3)ccc2NC1=O

nearest known ligand 0.82

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 14/20 0.82
PDE3A Q14432 14/20 0.82
PDE4A P27815 6/20 0.53
PDE4B Q07343 6/20 0.53
PDE4C Q08493 6/20 0.53
PDE4D Q08499 6/20 0.53
PARP1 P09874 2/20 0.46
CECR2 Q9BXF3 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.43
NPY1R P25929 1/20 0.43
NPY2R P49146 1/20 0.43

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
SCHEMBL7342167 0.90 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7343945 0.80 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7342522 0.80 PDE3B (0.66) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7485942 0.79 PDE3B (0.61) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9590230 0.77 PDE3B (0.59) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7341970 0.74 PDE3B (0.67) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7340613 0.73 PDE3B (0.67) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL410961 0.71 PARP1 (0.60) PDE3BPDE3APARP1CECR2
SCHEMBL30047902 0.71 PARP1 (0.60) PDE3BPDE3APARP1CECR2
SCHEMBL410960 0.71 PARP1 (0.60) PDE3BPDE3APARP1CECR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0272914-A2 6-Benzoxazinyl- and 6-benzothiazinyl-2,3,4,5-tetrahydropyridazin-3-ones ORTHO PHARMACEUTICAL CORPORATION (US) 1988-06-29 EP claimed
US-4721784-A MUSCLE RELAXANTS, BRONCHODILATOR AGENTS, CARDIOTONIC AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-01-26 US claimed
US-5081242-A Cardiotonic and bronchodilator agents; phosphodiesterase inhibitors ORTHO PHARMACEUTICAL CORPORATION (US) 1992-01-14 US disclosed
US-4766118-A CARDIOTONIC AGENTS, PHOSPHODIESTERASE INHIBITORS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-08-23 US disclosed
EP-0272914-A2 6-Benzoxazinyl- and 6-benzothiazinyl-2,3,4,5-tetrahydropyridazin-3-ones ORTHO PHARMACEUTICAL CORPORATION (US) 1988-06-29 EP disclosed
US-4721784-A MUSCLE RELAXANTS, BRONCHODILATOR AGENTS, CARDIOTONIC AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-01-26 US disclosed