SCHEMBL9570770

SCHEMBL9570770

Fc1ccc(COCC(c2ccc(C(F)(F)F)cc2)C(F)(F)F)nc1Oc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
CACNA1C Q13936 2/20 0.36
KCNK2 O95069 1/20 0.36
KCNH2 Q12809 1/20 0.36
SLC7A5 Q01650 4/20 0.34
TACR1 P25103 2/20 0.33
MAPK14 Q16539 1/20 0.33
CACNA1F O60840 1/20 0.33
CACNA1D Q01668 1/20 0.33
CACNA1S Q13698 1/20 0.33
RAB9A P51151 1/20 0.33
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
MAPT P10636 1/20 0.32
CYP2D6 P10635 1/20 0.32
SCN9A Q15858 2/20 0.32
ADORA2A P29274 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL9570609 0.89 RAB9A (0.30) RAB9AMAPT
SCHEMBL9570615 0.88 LTA4H (0.40) KCNH2RAB9AMAPTSCN9AMEN1
SCHEMBL9570605 0.79
SCHEMBL9862613 0.77 TACR1 (0.41) SLC6A2SLC6A4SLC6A3CACNA1CKCNK2
SCHEMBL9560399 0.77 TACR1 (0.41) SLC6A2SLC6A4SLC6A3CACNA1CKCNK2
SCHEMBL9570732 0.75 MEN1 (0.35) KCNH2SCN9AMEN1KMT2A
SCHEMBL9570872 0.74 CETP (0.48) CACNA1CTACR1MAPK14CACNA1FCACNA1D
SCHEMBL9862434 0.74 CETP (0.48) CACNA1CTACR1MAPK14CACNA1FCACNA1D
SCHEMBL10360769 0.72 KCNH2 (0.34) KCNH2RAB9AMAPTMEN1KMT2A
SCHEMBL9560496 0.72 CETP (0.36) SLC6A2SLC6A4SLC6A3KCNH2SLC7A5

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