SCHEMBL9570901

SCHEMBL9570901

FC(F)(F)COc1ccc(C(COCc2cccc(Oc3ccccc3)c2)C(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CETP P11597 10/20 0.49
FFAR1 O14842 7/20 0.43
FFAR4 Q5NUL3 1/20 0.42
TACR1 P25103 2/20 0.38
CACNA1F O60840 1/20 0.38
CACNA1D Q01668 1/20 0.38
CACNA1S Q13698 1/20 0.38
CACNA1C Q13936 1/20 0.38

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
SCHEMBL7930457 0.89 CETP (0.45) CETPFFAR1FFAR4TACR1CACNA1F
SCHEMBL409247 0.89 FFAR1 (0.51) CETPFFAR1FFAR4
SCHEMBL9561406 0.89 FFAR1 (0.51) CETPFFAR1FFAR4
SCHEMBL9862434 0.88 CETP (0.48) CETPFFAR1TACR1CACNA1FCACNA1D
SCHEMBL9570872 0.88 CETP (0.48) CETPFFAR1TACR1CACNA1FCACNA1D
SCHEMBL9570765 0.87 CETP (0.44) CETPFFAR1FFAR4
SCHEMBL9570640 0.87 FFAR1 (0.47) CETPFFAR1FFAR4
SCHEMBL9570753 0.86 CETP (0.41) CETPFFAR1FFAR4
SCHEMBL9560903 0.86 FFAR1 (0.46) CETPFFAR1FFAR4TACR1
SCHEMBL9560487 0.86 PPARG (0.47) CETPFFAR1FFAR4TACR1

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