SCHEMBL8658134

SCHEMBL8658134

FC(F)(F)Oc1ccc(SCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 9/20 0.37
SCN5A Q14524 2/20 0.37
CYP3A4 P08684 1/20 0.37
KCNH2 Q12809 1/20 0.37
CACNA1C Q13936 1/20 0.37
FFAR1 O14842 4/20 0.36
CYP2C9 P11712 1/20 0.36
PPARD Q03181 3/20 0.34
MAOB P27338 1/20 0.33
AOC3 Q16853 1/20 0.33
HTT P42858 1/20 0.32
PPARA Q07869 1/20 0.32
APLNR P35414 1/20 0.31
SCN8A Q9UQD0 1/20 0.31
RHEB Q15382 1/20 0.30
MRGPRX4 Q96LA9 1/20 0.30
GRIN2B Q13224 1/20 0.30

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
SCHEMBL8658661 0.88 PPARD (0.39) PPARDMAOBAOC3HTTPPARA
SCHEMBL8519621 0.88 FFAR4 (0.44) FFAR4SCN5ACYP3A4KCNH2CACNA1C
SCHEMBL8406151 0.88 FFAR4 (0.44) FFAR4SCN5ACYP3A4KCNH2CACNA1C
SCHEMBL8992644 0.86 HTR1A (0.33) PPARDHTTPPARA
SCHEMBL8408765 0.86 DRD2 (0.37) CYP3A4HTT
SCHEMBL8656070 0.85 ALDH1A1 (0.38) HTTPPARA
SCHEMBL8661839 0.85 PPARD (0.38) PPARDMAOBAOC3HTTPPARA
SCHEMBL8657400 0.84 FFAR4 (0.39) FFAR4SCN5ACYP3A4KCNH2CACNA1C
SCHEMBL8660335 0.84 PPARD (0.36) KCNH2PPARDHTT
SCHEMBL8656652 0.83 MCL1 (0.37) CYP3A4MAOBAOC3HTT

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-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