SCHEMBL10765644

SCHEMBL10765644

COc1cc(C=CC2=NNC(=O)CC2C)c(OC)c(OC)c1S(C)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 12/20 0.41
▸ PDE3B Q13370 8/20 0.41
▸ PDE4B Q07343 6/20 0.41
▸ PDE4A P27815 2/20 0.41
▸ PDE4C Q08493 2/20 0.41
▸ PDE4D Q08499 2/20 0.41
▸ GPR119 Q8TDV5 2/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ ABCB11 O95342 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ ADORA2A P29274 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NOD2 Q9HC29 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ SMN1; SMN2 Q16637 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
SCHEMBL10764225 0.85 PDE3A (0.48) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10761339 0.83 PDE3A (0.42) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10765392 0.82 PDE3A (0.41) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10767466 0.82 PTGS1 (0.44) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10766327 0.81 PDE3A (0.39) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10765495 0.81 PDE3A (0.39) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10760532 0.80 PDE3A (0.40) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10762558 0.80 PDE3A (0.44) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10764051 0.80 PDE3A (0.46) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10760509 0.80 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
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