SCHEMBL10760728

SCHEMBL10760728

CNc1ccc(C=CC2=NNC(=O)CC2C)cc1

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 11/20 0.73
▸ PDE3A Q14432 11/20 0.73
▸ APP P05067 3/20 0.41
▸ TNNC1 P63316 1/20 0.39
▸ PBRM1 Q86U86 1/20 0.37
▸ LMNA P02545 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ RAB9A P51151 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36

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
SCHEMBL10726010 0.85 PDE3B (1.00) PDE3BPDE3ALMNAKDM4EALDH1A1
SCHEMBL10726019 0.85 PDE3B (1.00) PDE3BPDE3ALMNAKDM4EALDH1A1
SCHEMBL10761737 0.85 PDE3B (0.67) PDE3BPDE3APBRM1LMNAKDM4E
SCHEMBL10765163 0.83 PDE3B (0.65) PDE3BPDE3APBRM1LMNAKDM4E
SCHEMBL10759796 0.83 PDE3B (0.69) PDE3BPDE3AAPPPBRM1LMNA
SCHEMBL7285568 0.83 PDE3B (0.65) PDE3BPDE3AAPPPBRM1LMNA
SCHEMBL10761216 0.83 PDE3B (0.65) PDE3BPDE3APBRM1LMNAKDM4E
SCHEMBL10761194 0.83 PDE3B (0.65) PDE3BPDE3APBRM1LMNAKDM4E
SCHEMBL10761240 0.81 PDE3B (0.62) PDE3BPDE3APBRM1LMNAKDM4E
SCHEMBL10767384 0.81 PDE3B (0.62) PDE3BPDE3AAPPLMNAALDH1A1

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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