SCHEMBL8410686

SCHEMBL8410686

F/C(Br)=C/COc1cc(Cl)c(OCCCOc2ccc(C(F)(F)F)cc2)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.40
AOC3 Q16853 1/20 0.40
RHOC P08134 1/20 0.38
RHOA P61586 1/20 0.38
PPARA Q07869 4/20 0.37
PPARD Q03181 4/20 0.37
NOS1 P29475 3/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1B1 Q16678 1/20 0.34
GRM4 Q14833 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
LTA4H P09960 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
SCHEMBL8410687 1.00 MAOB (0.40) MAOBAOC3RHOCRHOAPPARA
SCHEMBL8339294 0.98 MAOB (0.40) MAOBAOC3RHOCRHOAPPARA
SCHEMBL8339298 0.98 MAOB (0.40) MAOBAOC3RHOCRHOAPPARA
SCHEMBL8339303 0.92 PPARD (0.40) MAOBAOC3RHOCRHOAPPARA
SCHEMBL8339302 0.92 PPARD (0.40) MAOBAOC3RHOCRHOAPPARA
SCHEMBL8411298 0.91 MAOB (0.41) MAOBAOC3RHOCRHOAPPARA
SCHEMBL8344195 0.90 PPARD (0.40) MAOBAOC3RHOCRHOAPPARA
SCHEMBL8344192 0.90 PPARD (0.40) MAOBAOC3RHOCRHOAPPARA
SCHEMBL8412561 0.89 MAOB (0.40) MAOBAOC3RHOCRHOAPPARA
SCHEMBL8412565 0.89 MAOB (0.40) MAOBAOC3RHOCRHOAPPARA

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 3 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
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