SCHEMBL8227261

SCHEMBL8227261

CC=CCOc1c(Cl)cccc1OCCCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.43
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP2C9 P11712 1/20 0.41
MAPT P10636 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
HPGD P15428 2/20 0.38
KCNH2 Q12809 3/20 0.38
MCHR1 Q99705 1/20 0.37
HTR1A P08908 2/20 0.36
ADRA1D P25100 2/20 0.36
ADRA1A P35348 2/20 0.36
ADRA1B P35368 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GLA P06280 1/20 0.36
CHRM2 P08172 2/20 0.36
TSHR P16473 2/20 0.36
PTGES O14684 1/20 0.36
ALOX5 P09917 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL3787026 0.85 L3MBTL1 (0.57) L3MBTL1CYP1A2CYP2C19CYP2C9MAPT
SCHEMBL8223057 0.84 L3MBTL1 (0.44) L3MBTL1CYP1A2CYP2C19CYP2C9MAPT
SCHEMBL8222541 0.84 CYP1A2 (0.41) CYP1A2CYP2C19CYP2C9MAPTKCNH2
SCHEMBL8227797 0.84 L3MBTL1 (0.40) L3MBTL1CYP1A2CYP2C19CYP2C9MAPT
SCHEMBL8227802 0.84 L3MBTL1 (0.40) L3MBTL1CYP1A2CYP2C19CYP2C9MAPT
SCHEMBL8223061 0.81 L3MBTL1 (0.44) L3MBTL1CYP1A2CYP2C19CYP2C9MAPT
SCHEMBL19612363 0.79 L3MBTL1 (0.54) L3MBTL1CYP1A2CYP2C19CYP2C9MAPT
SCHEMBL8227265 0.77 L3MBTL1 (0.43) L3MBTL1CYP1A2CYP2C19CYP2C9MAPT
SCHEMBL8225537 0.77 L3MBTL1 (0.46) L3MBTL1CYP1A2CYP2C19CYP2C9MAPT
SCHEMBL3786544 0.76 L3MBTL1 (0.58) L3MBTL1MAPTTDP1HPGDKCNH2

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-6140274-A Dihalopropene compounds, their use as insecticides/acaricides and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-10-31 US disclosed