SCHEMBL10765731

SCHEMBL10765731

C#CC[S+]([O-])c1cc(C=CC2=NNC(=O)CC2C)ccc1OC

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 16/20 0.45
▸ PDE3B Q13370 7/20 0.45
▸ PDE4B Q07343 12/20 0.41
▸ PDE4A P27815 2/20 0.41
▸ PDE4C Q08493 2/20 0.41
▸ PDE4D Q08499 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ GPR119 Q8TDV5 1/20 0.32

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
SCHEMBL10765212 0.93 PDE3A (0.45) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10764359 0.87 PDE3A (0.45) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10761226 0.86 PDE3A (0.49) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10762398 0.83 PDE3A (0.39) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10764957 0.83 PDE3A (0.39) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10763910 0.82 PDE3B (0.54) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10763704 0.82 PDE3A (0.47) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10764022 0.82 RAB9A (0.53) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10764747 0.81 PDE3A (0.50) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10760131 0.81 PDE3B (0.45) 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
Send feedback