SCHEMBL8655977

SCHEMBL8655977

FC(F)(F)COc1ccc(OCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 9/20 0.42
PPARG P37231 6/20 0.38
PPARD Q03181 4/20 0.38
HTT P42858 2/20 0.38
FFAR1 O14842 1/20 0.34
CYP2C9 P11712 1/20 0.34
SCN5A Q14524 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.34
PAX8 Q06710 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
RHOC P08134 1/20 0.33
RHOA P61586 1/20 0.33

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
SCHEMBL8660357 0.98 PPARA (0.40) PPARAPPARGPPARDHTTFFAR1
SCHEMBL8658676 0.92 PPARA (0.38) PPARAPPARGPPARDHTTFFAR1
SCHEMBL8405535 0.90 PPARA (0.39) PPARAPPARDHTTFFAR1CYP2C9
SCHEMBL8658360 0.90 PPARA (0.36) PPARAPPARGPPARDHTTMAPT
SCHEMBL8656299 0.88 PPARA (0.41) PPARAPPARGPPARDHTTFFAR1
SCHEMBL8405597 0.88 MAOB (0.39) PPARAPPARDHTTFFAR1CYP2C9
SCHEMBL8406151 0.88 FFAR4 (0.44) PPARAPPARGPPARDHTTFFAR1
SCHEMBL8658417 0.87 HTT (0.37) PPARAPPARGPPARDHTTFFAR1
SCHEMBL8657375 0.86 PPARA (0.41) PPARAPPARGPPARDHTT
SCHEMBL8408726 0.86 HTT (0.42) PPARAHTTALDH1A1MEN1KMT2A

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