SCHEMBL8412641

SCHEMBL8412641

CCc1cc(OCC=C(F)Cl)cc(C)c1OCCCOc1ccc(C(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 12/20 0.42
PPARA Q07869 9/20 0.42
PPARG P37231 6/20 0.42
MAOB P27338 2/20 0.38
AOC3 Q16853 1/20 0.38
CYP1A1 P04798 2/20 0.37
CYP1B1 Q16678 2/20 0.37
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35

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
SCHEMBL8412636 1.00 PPARD (0.42) PPARDPPARAPPARGMAOBAOC3
SCHEMBL8345721 0.98 PPARD (0.40) PPARDPPARAPPARGMAOBAOC3
SCHEMBL8345719 0.98 PPARD (0.40) PPARDPPARAPPARGMAOBAOC3
SCHEMBL8412042 0.94 MAOB (0.41) PPARDPPARAPPARGMAOBAOC3
SCHEMBL8412039 0.94 MAOB (0.41) PPARDPPARAPPARGMAOBAOC3
SCHEMBL8408708 0.93 PPARD (0.43) PPARDPPARAPPARGMAOBAOC3
SCHEMBL8411750 0.92 PPARD (0.43) PPARDPPARAPPARGMAOBAOC3
SCHEMBL8341965 0.92 MAOB (0.41) PPARDPPARAPPARGMAOBAOC3
SCHEMBL8341962 0.92 MAOB (0.41) PPARDPPARAPPARGMAOBAOC3
SCHEMBL8658732 0.91 PPARD (0.41) PPARDPPARAPPARGMAOBAOC3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787710-B1 Fluoropropene compound, an insecticide containing the same and an intermediate for production thereof SUMITOMO CHEMICAL CO (JP) 1999-07-28 EP disclosed
US-5869506-A APPLYING TO ACARIDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-09 US disclosed
CN-1167104-A Fluoropropene compound, insecticide containing the same and intermediate for production thereof SUMITOMO CHEMICAL CO (JP) 1997-12-10 CN disclosed
EP-0787710-A1 Fluoropropene compound, an insecticide containing the same and an intermediate for production thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-06 EP disclosed