SCHEMBL11397697

SCHEMBL11397697

O=C1CCC(c2ccc(-c3ccc(F)cc3)cc2)=NN1CCO

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
LMNA P02545 4/20 0.44
KMT2A Q03164 2/20 0.44
PDE4B Q07343 2/20 0.44
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 1/20 0.43
TP53 P04637 4/20 0.43
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.41
HRH3 Q9Y5N1 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
SCHEMBL11400133 0.91 ALDH1A1 (0.45) THRBLMNAKMT2APDE4BALDH1A1
SCHEMBL11397127 0.91 PDE4B (0.49) THRBLMNAKMT2APDE4BALDH1A1
SCHEMBL11400866 0.87 KMT2A (0.56) THRBLMNAKMT2APDE4BALDH1A1
SCHEMBL11149657 0.84 KMT2A (0.58) THRBLMNAKMT2AALDH1A1MEN1
SCHEMBL11397250 0.83 PDE3B (0.48) THRBLMNAKMT2APDE4BALDH1A1
SCHEMBL11391393 0.82 PDE4B (0.46) THRBLMNAKMT2APDE4BALDH1A1
SCHEMBL11238845 0.82 KMT2A (0.45) THRBLMNAKMT2APDE4BALDH1A1
SCHEMBL21144549 0.81 PDE4B (0.47) THRBLMNAKMT2APDE4BALDH1A1
SCHEMBL17504206 0.80 TP53 (0.54) LMNAKMT2AALDH1A1MEN1TP53
SCHEMBL11401967 0.78 TP53 (0.50) THRBLMNAKMT2APDE4BALDH1A1

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-0010156-A1 6-Arylpyridazine-3-ones, pharmaceutical compositions containing them and process for their preparation MERCK PATENT GmbH (DE) 1980-04-30 EP claimed
US-4289774-A Lipid lowering and anti-thrombotic 6-arylpyridazin-3-ones and a process for their preparation MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1981-09-15 US disclosed
EP-0010156-A1 6-Arylpyridazine-3-ones, pharmaceutical compositions containing them and process for their preparation MERCK PATENT GmbH (DE) 1980-04-30 EP disclosed