SCHEMBL9570872

SCHEMBL9570872

FC(F)(F)c1ccc(C(COCc2cccc(Oc3ccccc3)c2)C(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CETP P11597 5/20 0.48
TACR1 P25103 6/20 0.44
CACNA1F O60840 1/20 0.44
CACNA1D Q01668 1/20 0.44
CACNA1S Q13698 1/20 0.44
CACNA1C Q13936 1/20 0.44
FFAR1 O14842 2/20 0.43
MAPK14 Q16539 2/20 0.43
FDFT1 P37268 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.42

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
SCHEMBL9862434 1.00 CETP (0.48) CETPTACR1CACNA1FCACNA1DCACNA1S
SCHEMBL9560931 0.92 CETP (0.41) CETPTACR1CACNA1FCACNA1DCACNA1S
SCHEMBL7930457 0.91 CETP (0.45) CETPTACR1CACNA1FCACNA1DCACNA1S
SCHEMBL9570907 0.91 FAAH (0.42) CETPTACR1CACNA1FCACNA1DCACNA1S
SCHEMBL9570636 0.90 FFAR1 (0.44) CETPFFAR1FDFT1MRGPRX4
SCHEMBL9570863 0.89 TACR1 (0.46) CETPTACR1CACNA1FCACNA1DCACNA1S
SCHEMBL9570765 0.89 CETP (0.44) CETPFFAR1FDFT1
SCHEMBL9570901 0.88 CETP (0.49) CETPTACR1CACNA1FCACNA1DCACNA1S
SCHEMBL9560683 0.88 KDM4E (0.50) CETPTACR1FFAR1
SCHEMBL9570753 0.88 CETP (0.41) CETPFFAR1

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 6 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-4988826-A Fluoroalkylstyrene derivatives as intermediates for insecticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-29 US disclosed
US-4891450-A FLUORINE-CONTAINING ARYLALKENES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-01-02 US disclosed
US-4840971-A INSECTICIDES, MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-20 US disclosed
EP-0280383-A1 Process for intermediates for insecticidal compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-08-31 EP 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