SCHEMBL8519621

SCHEMBL8519621

FC(F)(F)Oc1ccc(OCCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 9/20 0.44
FFAR1 O14842 4/20 0.44
SCN5A Q14524 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP3A4 P08684 1/20 0.40
KCNH2 Q12809 1/20 0.40
CACNA1C Q13936 1/20 0.40
PPARD Q03181 4/20 0.39
PPARA Q07869 4/20 0.39
MAOB P27338 1/20 0.39
AOC3 Q16853 1/20 0.39
HTT P42858 1/20 0.38
PPARG P37231 2/20 0.36
CHRM5 P08912 1/20 0.35
EPHX2 P34913 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
ATM Q13315 1/20 0.34

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
SCHEMBL8406151 0.98 FFAR4 (0.44) FFAR4FFAR1SCN5ACYP2C9CYP3A4
SCHEMBL8657064 0.92 FFAR4 (0.46) FFAR4FFAR1SCN5ACYP2C9CYP3A4
SCHEMBL8339382 0.92 FFAR4 (0.41) FFAR4FFAR1SCN5ACYP2C9CYP3A4
SCHEMBL8339380 0.92 FFAR4 (0.41) FFAR4FFAR1SCN5ACYP2C9CYP3A4
SCHEMBL8519267 0.91 FFAR4 (0.38) FFAR4FFAR1SCN5ACYP2C9CYP3A4
SCHEMBL8407785 0.90 FFAR4 (0.46) FFAR4FFAR1SCN5ACYP2C9CYP3A4
SCHEMBL8657400 0.90 FFAR4 (0.39) FFAR4FFAR1SCN5ACYP2C9CYP3A4
SCHEMBL8659478 0.90 FFAR4 (0.40) FFAR4FFAR1SCN5ACYP2C9CYP3A4
SCHEMBL8408713 0.90 HTT (0.38) FFAR4FFAR1SCN5ACYP2C9CYP3A4
SCHEMBL8339364 0.89 FFAR4 (0.41) FFAR4FFAR1SCN5ACYP2C9CYP3A4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5872137-A AROMATIC OXY DIHALOPRENE COMPOUNDS INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-16 US claimed
EP-0722430-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 1998-10-21 EP claimed
EP-0722430-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 1998-10-21 EP disclosed
EP-0722430-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-07-24 EP disclosed
WO-1996004228-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-02-15 WO disclosed