SCHEMBL9636069

SCHEMBL9636069

O=c1cc(C=Cc2ccc(Cl)cc2)occ1O

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
APP P05067 13/20 0.77
HRH3 Q9Y5N1 6/20 0.54
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
DAO P14920 2/20 0.48
ALOX5 P09917 1/20 0.47
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47

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
SCHEMBL9636066 1.00 APP (0.77) APPHRH3MAOAMAOBDAO
SCHEMBL8398565 0.83 APP (0.76) APPHRH3
SCHEMBL8398561 0.83 APP (0.76) APPHRH3
SCHEMBL9637404 0.80 APP (0.70) APPHRH3ALOX5PTGS1PTGS2
SCHEMBL9637407 0.80 APP (0.70) APPHRH3ALOX5PTGS1PTGS2
SCHEMBL3368559 0.78 APP (0.67) APPHRH3
SCHEMBL3370878 0.78 APP (0.67) APPHRH3
SCHEMBL9976079 0.75 APP (0.62) APPHRH3DAOALOX5PTGS1
SCHEMBL902342 0.74 APP (0.62) APPHRH3
SCHEMBL10145183 0.71 APP (0.58) APPDAO

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
US-5093505-A Pyranone and pyran-thione derivatives WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1992-03-03 US disclosed