SCHEMBL7287604

SCHEMBL7287604

O=C1CCC(c2ccc(-n3cccc3)cc2)=NN1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 10/20 0.70
PDE3A Q14432 10/20 0.70
PDE4B Q07343 4/20 0.70
PDE4A P27815 3/20 0.70
PDE4C Q08493 3/20 0.70
PDE4D Q08499 3/20 0.70
LMNA P02545 2/20 0.70
CYP1A2 P05177 1/20 0.70
CYP3A4 P08684 1/20 0.70
CYP2D6 P10635 1/20 0.70
CYP2C9 P11712 1/20 0.70
TSHR P16473 1/20 0.70
MAPK1 P28482 1/20 0.70
CYP2C19 P33261 1/20 0.70
SMN1; SMN2 Q16637 1/20 0.63
PDE2A O00408 3/20 0.56
KCNH2 Q12809 1/20 0.51
PDE1A P54750 1/20 0.51
PDE1B Q01064 1/20 0.51
PDE1C Q14123 1/20 0.51

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
SCHEMBL7318837 0.89 PDE3B (0.68) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL7286021 0.84 PDE3B (0.70) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL10353452 0.83 SMN1; SMN2 (0.81) PDE3BPDE3APDE4BPDE4APDE4C
Imazodan SCHEMBL148436 0.82 PDE3B (1.00) PDE3BPDE3APDE4BPDE4APDE4C
Imazodan SCHEMBL124243 0.81 PDE3B (0.97) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL10548480 0.80 PDE3B (0.47) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL10745652 0.78 PDE3B (0.65) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL2798028 0.78 SMN1; SMN2 (1.00) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL21969534 0.77 GPR119 (0.57) PDE3BPDE3APDE4BPDE4APDE4C
SCHEMBL9687996 0.76 SMN1; SMN2 (0.70) PDE3BPDE3APDE4BPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0075436-A1 Substituted 4,5-dihydro-6-(substituted)-phenyl-3(2H)-pyridazinones and 6-(substituted)phenyl-3(2H)-pyridazinones WARNER-LAMBERT COMPANY (US) 1983-03-30 EP claimed
US-4734415-A CARDIOTONIC, HYPOTENSIVE WARNER-LAMBERT COMPANY (US) 1988-03-29 US disclosed
EP-0075436-A1 Substituted 4,5-dihydro-6-(substituted)-phenyl-3(2H)-pyridazinones and 6-(substituted)phenyl-3(2H)-pyridazinones WARNER-LAMBERT COMPANY (US) 1983-03-30 EP disclosed