SCHEMBL7267653

SCHEMBL7267653

O=C1CCC(c2ccc(N3CCNCC3)c([N+](=O)[O-])c2)=NN1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.45
PDE4B Q07343 2/20 0.45
PDE4C Q08493 2/20 0.45
PDE4D Q08499 2/20 0.45
GPR119 Q8TDV5 2/20 0.44
PDE3B Q13370 7/20 0.44
PDE3A Q14432 7/20 0.44
MAPT P10636 7/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
ALDH1A1 P00352 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPK1 P28482 1/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL10760147 0.88 MAPT (0.53) GPR119PDE3BPDE3AMAPTLMNA
SCHEMBL7267124 0.83 PDE3B (0.41) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL10430050 0.82 MAPT (0.44) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7267606 0.80 MAPT (0.60) GPR119PDE3BPDE3AMAPTLMNA
SCHEMBL7266917 0.79 GALR3 (0.66) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL7273699 0.79 PDE3B (0.54) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL7273670 0.78 PDE3B (0.50) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL7267599 0.78 MAPT (0.48) GPR119PDE3BPDE3AMAPTLMNA
SCHEMBL10333086 0.77 MAPT (0.59) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL11703472 0.77 PDE3B (0.49) PDE4APDE4BPDE4CPDE4DGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0339208-B1 6-Oxopyridazine derivatives, process for their preparation and medicaments containing these compounds HEUMANN PHARMA GMBH & CO (DE) 1996-02-07 EP disclosed
EP-0327800-B1 6-PHENYLDIHYDRO-3(2H)-PYRIDAZINONES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS HEUMANN PHARMA GMBH & CO (DE) 1992-05-27 EP disclosed
US-4968683-A INOTROPIC, CARDIOTONIC HEUMANN PHARMA GMBH & CO. (DE) 1990-11-06 US disclosed
US-4954501-A INOTROPIC AGENTS HEUMANN PHARMA GMBH & CO. (DE) 1990-09-04 US disclosed
EP-0327800-A2 6-Phenyldihydro-3(2H)-pyridazinones, process for their preparation and medicines containing these compounds HEUMANN PHARMA GMBH & CO (DE) 1989-08-16 EP disclosed