SCHEMBL10649279

SCHEMBL10649279

C#CC(CC)(CCCc1cccc(Oc2ccccc2)c1)c1ccc(OCCCC)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.48
PPARG P37231 3/20 0.39
CYP2D6 P10635 2/20 0.39
PPARA Q07869 3/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CETP P11597 1/20 0.38
FDFT1 P37268 2/20 0.37
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
PLA2G4B P0C869 1/20 0.37

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
SCHEMBL10647483 0.97 LTA4H (0.44) LTA4HPPARGCYP2D6PPARATSHR
SCHEMBL10649141 0.93 LTA4H (0.45) LTA4HTSHRHSD17B10CETPFDFT1
SCHEMBL10648184 0.90 LTA4H (0.44) LTA4HPPARGPPARATSHRHSD17B10
SCHEMBL10648017 0.88 FDFT1 (0.45) LTA4HPPARGTSHRHSD17B10CETP
SCHEMBL10648340 0.88 FDFT1 (0.41) TSHRHSD17B10FDFT1
SCHEMBL10652108 0.88 BCHE (0.40) LTA4HTSHRHSD17B10FDFT1FFAR1
SCHEMBL10648019 0.88 LTA4H (0.44) LTA4HPPARGPPARATSHRHSD17B10
SCHEMBL10649802 0.87 ALDH1A1 (0.41) PPARGPPARATSHRHSD17B10FDFT1
SCHEMBL10649380 0.87 FDFT1 (0.39) PPARGPPARATSHRHSD17B10CETP
SCHEMBL10647402 0.87 CETP (0.41) PPARGPPARATSHRHSD17B10CETP

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-0193189-B1 NOVEL COMPOUND, ITS PRODUCTION AND INSECTICIDAL AND ACARICIDAL COMPOSITION CONTAINING IT AS AN ACTIVE INGREDIENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-09-28 EP disclosed
US-4772633-A 6-pyridyl- and 6-phenyl-3-phenyl-1-hexenes and -1-hexynes, composition containing them, and insecticidal and acaricidal method of using them SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-09-20 US disclosed
EP-0193189-A1 Novel compound, its production and insecticidal and acaricidal composition containing it as an active ingredient SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-09-03 EP disclosed