SCHEMBL10761696

SCHEMBL10761696

C#CCS(=O)(=O)c1ccc(C=CC2=NNC(=O)CC2C)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 13/20 0.47
▸ PDE3B Q13370 6/20 0.47
▸ PDE4B Q07343 9/20 0.39
▸ PDE4A P27815 1/20 0.39
▸ PDE4C Q08493 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ GPR119 Q8TDV5 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ APP P05067 1/20 0.31

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
SCHEMBL10761165 0.93 PDE3A (0.47) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10764735 0.86 PDE3A (0.45) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10766381 0.85 PDE3A (0.50) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10769779 0.83 PDE3A (0.37) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10764436 0.83 PDE3A (0.37) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10759798 0.82 PDE3B (0.59) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10763704 0.82 PDE3A (0.47) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10760345 0.82 RAB9A (0.53) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10765577 0.81 PDE3B (0.47) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10766102 0.80 PDE3B (0.58) PDE3APDE3BPDE4BPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0210530-A1 6-Arylalkenyl pyridazinones MERCK PATENT GmbH (DE) 1987-02-04 — — EP disclosed
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