SCHEMBL8658281

SCHEMBL8658281

CC(C)Oc1ccc(CCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 7/20 0.39
PLAU P00749 1/20 0.38
ACACB O00763 2/20 0.37
HTT P42858 1/20 0.36
POLB P06746 1/20 0.35
CACNA1B Q00975 2/20 0.35
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.33
GAA P10253 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
GCK P35557 1/20 0.32

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
SCHEMBL8407599 0.88 HTT (0.40) FFAR4PLAUACACBHTTKDM4E
SCHEMBL8406348 0.88 HTT (0.40) FFAR4PLAUHTTKDM4E
SCHEMBL8655699 0.87 HTT (0.39) HTT
SCHEMBL8658754 0.85 PPARG (0.37) HTT
SCHEMBL8518771 0.85 MAOB (0.38) HTT
SCHEMBL8657189 0.84 PPARA (0.38) HTTCYP1A2CYP2D6CYP2C19
SCHEMBL8409332 0.83 PPARD (0.40) FFAR4HTT
SCHEMBL6549961 0.83 PPARG (0.35) HTTPOLB
SCHEMBL8519414 0.83 HPGD (0.38) PLAUHTT
SCHEMBL8658039 0.82 PLAU (0.35) FFAR4PLAUHTT

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