SCHEMBL10765683

SCHEMBL10765683

C=CCS(=O)(=O)c1cc(C=CC2=NNC(=O)CC2C)ccc1OC

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 14/20 0.45
▸ PDE3B Q13370 6/20 0.45
▸ PDE4B Q07343 9/20 0.42
▸ PDE4A P27815 1/20 0.42
▸ PDE4C Q08493 1/20 0.42
▸ PDE4D Q08499 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ POLB P06746 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ GSK3B P49841 1/20 0.33

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
SCHEMBL10764735 0.92 PDE3A (0.45) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10763474 0.86 PDE3A (0.50) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10761165 0.86 PDE3A (0.47) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10771165 0.82 PDE3A (0.40) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10764072 0.81 PDE3B (0.57) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10762648 0.81 RAB9A (0.54) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10766102 0.81 PDE3B (0.58) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10766791 0.80 PDE3B (0.46) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10766381 0.80 PDE3A (0.50) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10761200 0.80 PDE3A (0.46) 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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