SCHEMBL9570615

SCHEMBL9570615

CCOc1ccc(C(COCc2ccc(F)c(Oc3ccccc3)n2)C(F)(F)F)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.40
LMNA P02545 2/20 0.33
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 2/20 0.33
MAPT P10636 1/20 0.33
FFAR1 O14842 3/20 0.32
CETP P11597 1/20 0.32
KCNH2 Q12809 1/20 0.32
DRD2 P14416 1/20 0.31
HTR2A P28223 1/20 0.31
HRH1 P35367 1/20 0.31
KAT6A Q92794 1/20 0.31
CNR2 P34972 1/20 0.31
SYK P43405 1/20 0.31
CYSLTR2 Q9NS75 1/20 0.31
CYSLTR1 Q9Y271 1/20 0.31
SCN9A Q15858 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RAB9A P51151 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL9570770 0.88 SLC6A2 (0.36) MAPTKCNH2SCN9ARAB9AMEN1
SCHEMBL9570609 0.88 RAB9A (0.30) MAPTRAB9A
SCHEMBL9560885 0.83 LTA4H (0.42) LTA4HLMNAKDM4ENPC1MAPT
SCHEMBL409992 0.78 LTA4H (0.41) LTA4HLMNAMAPTFFAR1CETP
SCHEMBL9570605 0.78
SCHEMBL409247 0.75 FFAR1 (0.51) LTA4HFFAR1CETPCNR2
SCHEMBL9561406 0.75 FFAR1 (0.51) LTA4HFFAR1CETPCNR2
SCHEMBL9570732 0.73 MEN1 (0.35) LTA4HKCNH2SCN9AMEN1KMT2A
SCHEMBL9570772 0.73 FFAR1 (0.41) LTA4HFFAR1CETP
SCHEMBL4332048 0.73 NQO1 (0.50) LTA4HLMNAKDM4EMAPTCNR2

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-0545891-A2 Aldehyde compounds and derivatives thereof useful as intermediates in the preparation of insectical ether compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-06-09 EP disclosed
US-4840971-A INSECTICIDES, MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-20 US disclosed
EP-0240978-A2 Ether compounds, process for their preparation, compositions containing the same and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-14 EP disclosed